cumene;3-cyclopropyl-5-propan-2-ylpyridine;3-methoxy-5-propan-2-ylpyridine;4-(3-methylbutyl)morpholine;3-methyl-2-propan-2-ylpyridine;bis(3-methyl-5-propan-2-ylpyridine);4-methyl-2-propan-2-ylpyridine;2-methylpropylbenzene;2-methylpropylcyclopropane;2-(2-methylpropyl)pyridine;3-propan-2-yl-5-propan-2-yloxypyridine;2-propan-2-ylpyrazine;3-propan-2-ylpyridine;5-propan-2-ylpyridin-3-ol;5-propan-2-ylpyrimidine

C150H223N15O4 — CID 157367277

IUPACcumene;3-cyclopropyl-5-propan-2-ylpyridine;3-methoxy-5-propan-2-ylpyridine;4-(3-methylbutyl)morpholine;3-methyl-2-propan-2-ylpyridine;bis(3-methyl-5-propan-2-ylpyridine);4-methyl-2-propan-2-ylpyridine;2-methylpropylbenzene;2-methylpropylcyclopropane;2-(2-methylpropyl)pyridine;3-propan-2-yl-5-propan-2-yloxypyridine;2-propan-2-ylpyrazine;3-propan-2-ylpyridine;5-propan-2-ylpyridin-3-ol;5-propan-2-ylpyrimidine
SMILESCC(C)CC1CC1.CC(C)CCN1CCOCC1.CC(C)Cc1ccccc1.CC(C)Cc1ccccn1.CC(C)Oc1cncc(C(C)C)c1.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1cccnc1.CC(C)c1cncc(C2CC2)c1.CC(C)c1cncc(O)c1.CC(C)c1cnccn1.CC(C)c1cncnc1.COc1cncc(C(C)C)c1.Cc1cccnc1C(C)C.Cc1ccnc(C(C)C)c1.Cc1cncc(C(C)C)c1.Cc1cncc(C(C)C)c1
InChIInChI=1S/C11H17NO.C11H15N.C10H14.C9H13NO.C9H19NO.5C9H13N.2C9H12.C8H11NO.C8H11N.2C7H10N2.C7H14/c1-8(2)10-5-11(7-12-6-10)13-9(3)4;1-8(2)10-5-11(7-12-6-10)9-3-4-9;1-9(2)8-10-6-4-3-5-7-10;1-7(2)8-4-9(11-3)6-10-5-8;1-9(2)3-4-10-5-7-11-8-6-10;2*1-7(2)9-4-8(3)5-10-6-9;1-7(2)9-6-8(3)4-5-10-9;1-7(2)9-8(3)5-4-6-10-9;1-8(2)7-9-5-3-4-6-10-9;2*1-8(2)9-6-4-3-5-7-9;1-6(2)7-3-8(10)5-9-4-7;1-7(2)8-4-3-5-9-6-8;1-6(2)7-3-8-5-9-4-7;1-6(2)7-5-8-3-4-9-7;1-6(2)5-7-3-4-7/h5-9H,1-4H3;5-9H,3-4H2,1-2H3;3-7,9H,8H2,1-2H3;4-7H,1-3H3;9H,3-8H2,1-2H3;4*4-7H,1-3H3;3-6,8H,7H2,1-2H3;2*3-8H,1-2H3;3-6,10H,1-2H3;3-7H,1-2H3;2*3-6H,1-2H3;6-7H,3-5H2,1-2H3
InChIKeyBJIJWKHMCREZEA-UHFFFAOYSA-N
MW2300.53 g/mol
LogP40.25
Rot. Bonds26

About cumene;3-cyclopropyl-5-propan-2-ylpyridine;3-methoxy-5-propan-2-ylpyridine;4-(3-methylbutyl)morpholine;3-methyl-2-propan-2-ylpyridine;bis(3-methyl-5-propan-2-ylpyridine);4-methyl-2-propan-2-ylpyridine;2-methylpropylbenzene;2-methylpropylcyclopropane;2-(2-methylpropyl)pyridine;3-propan-2-yl-5-propan-2-yloxypyridine;2-propan-2-ylpyrazine;3-propan-2-ylpyridine;5-propan-2-ylpyridin-3-ol;5-propan-2-ylpyrimidine

cumene;3-cyclopropyl-5-propan-2-ylpyridine;3-methoxy-5-propan-2-ylpyridine;4-(3-methylbutyl)morpholine;3-methyl-2-propan-2-ylpyridine;bis(3-methyl-5-propan-2-ylpyridine);4-methyl-2-propan-2-ylpyridine;2-methylpropylbenzene;2-methylpropylcyclopropane;2-(2-methylpropyl)pyridine;3-propan-2-yl-5-propan-2-yloxypyridine;2-propan-2-ylpyrazine;3-propan-2-ylpyridine;5-propan-2-ylpyridin-3-ol;5-propan-2-ylpyrimidine (PubChem CID 157367277) has the molecular formula C150H223N15O4 and a molecular weight of 2300.53 g/mol. Its IUPAC name is cumene;3-cyclopropyl-5-propan-2-ylpyridine;3-methoxy-5-propan-2-ylpyridine;4-(3-methylbutyl)morpholine;3-methyl-2-propan-2-ylpyridine;bis(3-methyl-5-propan-2-ylpyridine);4-methyl-2-propan-2-ylpyridine;2-methylpropylbenzene;2-methylpropylcyclopropane;2-(2-methylpropyl)pyridine;3-propan-2-yl-5-propan-2-yloxypyridine;2-propan-2-ylpyrazine;3-propan-2-ylpyridine;5-propan-2-ylpyridin-3-ol;5-propan-2-ylpyrimidine.

Molecular Properties

Compound Namecumene;3-cyclopropyl-5-propan-2-ylpyridine;3-methoxy-5-propan-2-ylpyridine;4-(3-methylbutyl)morpholine;3-methyl-2-propan-2-ylpyridine;bis(3-methyl-5-propan-2-ylpyridine);4-methyl-2-propan-2-ylpyridine;2-methylpropylbenzene;2-methylpropylcyclopropane;2-(2-methylpropyl)pyridine;3-propan-2-yl-5-propan-2-yloxypyridine;2-propan-2-ylpyrazine;3-propan-2-ylpyridine;5-propan-2-ylpyridin-3-ol;5-propan-2-ylpyrimidine
PubChem CID157367277
Molecular FormulaC150H223N15O4
Molecular Weight2300.53 g/mol
Exact Mass2298.77
IUPAC Namecumene;3-cyclopropyl-5-propan-2-ylpyridine;3-methoxy-5-propan-2-ylpyridine;4-(3-methylbutyl)morpholine;3-methyl-2-propan-2-ylpyridine;bis(3-methyl-5-propan-2-ylpyridine);4-methyl-2-propan-2-ylpyridine;2-methylpropylbenzene;2-methylpropylcyclopropane;2-(2-methylpropyl)pyridine;3-propan-2-yl-5-propan-2-yloxypyridine;2-propan-2-ylpyrazine;3-propan-2-ylpyridine;5-propan-2-ylpyridin-3-ol;5-propan-2-ylpyrimidine
SMILESCC(C)CC1CC1.CC(C)CCN1CCOCC1.CC(C)Cc1ccccc1.CC(C)Cc1ccccn1.CC(C)Oc1cncc(C(C)C)c1.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1cccnc1.CC(C)c1cncc(C2CC2)c1.CC(C)c1cncc(O)c1.CC(C)c1cnccn1.CC(C)c1cncnc1.COc1cncc(C(C)C)c1.Cc1cccnc1C(C)C.Cc1ccnc(C(C)C)c1.Cc1cncc(C(C)C)c1.Cc1cncc(C(C)C)c1
InChIInChI=1S/C11H17NO.C11H15N.C10H14.C9H13NO.C9H19NO.5C9H13N.2C9H12.C8H11NO.C8H11N.2C7H10N2.C7H14/c1-8(2)10-5-11(7-12-6-10)13-9(3)4;1-8(2)10-5-11(7-12-6-10)9-3-4-9;1-9(2)8-10-6-4-3-5-7-10;1-7(2)8-4-9(11-3)6-10-5-8;1-9(2)3-4-10-5-7-11-8-6-10;2*1-7(2)9-4-8(3)5-10-6-9;1-7(2)9-6-8(3)4-5-10-9;1-7(2)9-8(3)5-4-6-10-9;1-8(2)7-9-5-3-4-6-10-9;2*1-8(2)9-6-4-3-5-7-9;1-6(2)7-3-8(10)5-9-4-7;1-7(2)8-4-3-5-9-6-8;1-6(2)7-3-8-5-9-4-7;1-6(2)7-5-8-3-4-9-7;1-6(2)5-7-3-4-7/h5-9H,1-4H3;5-9H,3-4H2,1-2H3;3-7,9H,8H2,1-2H3;4-7H,1-3H3;9H,3-8H2,1-2H3;4*4-7H,1-3H3;3-6,8H,7H2,1-2H3;2*3-8H,1-2H3;3-6,10H,1-2H3;3-7H,1-2H3;2*3-6H,1-2H3;6-7H,3-5H2,1-2H3
InChIKeyBJIJWKHMCREZEA-UHFFFAOYSA-N
XLogP40.25
TPSA231.62 Ų
H-Bond Donors1
H-Bond Acceptors19
Rotatable Bonds26
Heavy Atoms169
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002300.53
LogP ≤ 540.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1019

Analyze cumene;3-cyclopropyl-5-propan-2-ylpyridine;3-methoxy-5-propan-2-ylpyridine;4-(3-methylbutyl)morpholine;3-methyl-2-propan-2-ylpyridine;bis(3-methyl-5-propan-2-ylpyridine);4-methyl-2-propan-2-ylpyridine;2-methylpropylbenzene;2-methylpropylcyclopropane;2-(2-methylpropyl)pyridine;3-propan-2-yl-5-propan-2-yloxypyridine;2-propan-2-ylpyrazine;3-propan-2-ylpyridine;5-propan-2-ylpyridin-3-ol;5-propan-2-ylpyrimidine with MolForge

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Launch Full Analysis

Related Compounds

2,4-dimethyl-6-propan-2-ylpyridine;4-[2-(4-propan-2-ylphenyl)ethyl]morpholine;4-[(4-propan-2-ylphenyl)methyl]morpholine;4-(3-propan-2-ylphenyl)morpholine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;4-[(2-propan-2-yl-4-pyridinyl)methyl]morpholine;4-[(4-propan-2-yl-2-pyridinyl)methyl]morpholine;4-[(5-propan-2-yl-3-pyridinyl)methyl]morpholine;4-[(6-propan-2-yl-2-pyridinyl)methyl]morpholine;4-[(6-propan-2-yl-3-pyridinyl)methyl]morpholine;3-[(4-propan-2-yl-2-pyridinyl)oxy]propane-1,2-diol;3-[(6-propan-2-yl-2-pyridinyl)oxy]propane-1,2-diol
CID 160619287
cumene;1-methoxy-3-(2-methylpropyl)benzene;tris(1-methoxy-4-(2-methylpropyl)benzene);bis(3-methylbutan-2-ylbenzene);2-(3-methylbutan-2-yl)pyridine;3-methylbutoxybenzene;2-(3-methylbutyl)pyridine;1-methyl-4-(2-methylpropyl)benzene;2-methylpropylbenzene;2-methylpropylcyclopropane;1-(2-methylpropyl)-4-methylsulfonylbenzene;2-(2-methylpropyl)oxolane;2-(2-methylpropyl)pyridine;4-(2-methylpropyl)-2-pyridin-3-yl-1,3-thiazole;5-(2-methylpropyl)pyrrolidin-2-one;2-(2-methylpropyl)-1,3-thiazole
CID 158941244
1-methoxy-4-(2-methylpropyl)benzene;1-methoxy-4-propan-2-ylbenzene;3-methylbutan-1-ol;1-methyl-4-(2-methylpropyl)piperazine;2-methylpentane;2-methylpropylbenzene;2-methylpropylcyclohexane;4-(2-methylpropyl)morpholine;5-propan-2-yl-1,3-benzodioxole;propan-2-ylcyclopentane
CID 159315161
5-(6-ethoxypyrazin-2-yl)-N-[(1R)-1-(4-methyl-2-pyridinyl)-3-morpholin-4-ylpropyl]-1,3-thiazole-2-carboxamide;methylcyclopropane;molecular hydrogen
CID 163271180
6-[(3-methoxyphenyl)methyl]-4-(pyridin-2-ylmethyl)-1,4-oxazepane
CID 155983978
ethane;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine
CID 159241215
2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;4-propan-2-ylpyrimidine
CID 157089841
bis(2-methylpropylbenzene);2-(2-methylpropyl)pyrazine;2-(2-methylpropyl)pyridine;3-(2-methylpropyl)pyridine;4-(2-methylpropyl)pyridine;2-(2-methylpropyl)pyrimidine;4-(2-methylpropyl)pyrimidine
CID 159695001
3-tert-butyl-4-chloro-2-methylpyridine;3-tert-butyl-4-chloro-5-methylpyridine;3-tert-butyl-6-cyclopropyl-2-methylpyridine;5-tert-butyl-N,N-dimethylpyridin-2-amine;5-tert-butyl-2-ethyl-3-methylpyridine;5-tert-butyl-2-(1-ethynylcyclopropyl)pyridine;3-tert-butyl-2-methoxy-5-methylpyridine;3-tert-butyl-5-methoxy-4-methylpyridine;5-tert-butyl-2-methoxy-3-methylpyridine;3-tert-butyl-5-methoxypyridine;5-tert-butyl-2-methoxypyridine;4-tert-butyl-6-methoxypyrimidine;3-tert-butyl-5-(2-methylidenepyrrolidin-1-yl)pyridine;3-tert-butyl-5-propan-2-yloxypyridine;4-tert-butyl-6-propan-2-ylpyrimidine;4-tert-butylpyridazine;2,3-dimethoxy-5-propan-2-ylpyridine;4-methoxy-3-propan-2-ylpyridine;2-propan-2-ylpyrazine;3-propan-2-ylpyridine;4-(5-propan-2-yl-3-pyridinyl)morpholine;4-propan-2-ylpyrimidine;3-propan-2-yl-5-pyrrolidin-1-ylpyridine
CID 159368728
(1R)-N-[[3-(morpholin-4-ylmethyl)phenyl]methyl]-1-pyridin-3-ylethanamine
CID 124516341
[1-(5-methoxy-3-pyridinyl)-2-pyridin-2-ylethyl]hydrazine
CID 105200033
4-[3-(3-methoxyphenoxy)-3-phenylpropyl]morpholine
CID 3074452

Frequently Asked Questions

What is the IUPAC name of cumene;3-cyclopropyl-5-propan-2-ylpyridine;3-methoxy-5-propan-2-ylpyridine;4-(3-methylbutyl)morpholine;3-methyl-2-propan-2-ylpyridine;bis(3-methyl-5-propan-2-ylpyridine);4-methyl-2-propan-2-ylpyridine;2-methylpropylbenzene;2-methylpropylcyclopropane;2-(2-methylpropyl)pyridine;3-propan-2-yl-5-propan-2-yloxypyridine;2-propan-2-ylpyrazine;3-propan-2-ylpyridine;5-propan-2-ylpyridin-3-ol;5-propan-2-ylpyrimidine?
The IUPAC name of cumene;3-cyclopropyl-5-propan-2-ylpyridine;3-methoxy-5-propan-2-ylpyridine;4-(3-methylbutyl)morpholine;3-methyl-2-propan-2-ylpyridine;bis(3-methyl-5-propan-2-ylpyridine);4-methyl-2-propan-2-ylpyridine;2-methylpropylbenzene;2-methylpropylcyclopropane;2-(2-methylpropyl)pyridine;3-propan-2-yl-5-propan-2-yloxypyridine;2-propan-2-ylpyrazine;3-propan-2-ylpyridine;5-propan-2-ylpyridin-3-ol;5-propan-2-ylpyrimidine (CID 157367277) is cumene;3-cyclopropyl-5-propan-2-ylpyridine;3-methoxy-5-propan-2-ylpyridine;4-(3-methylbutyl)morpholine;3-methyl-2-propan-2-ylpyridine;bis(3-methyl-5-propan-2-ylpyridine);4-methyl-2-propan-2-ylpyridine;2-methylpropylbenzene;2-methylpropylcyclopropane;2-(2-methylpropyl)pyridine;3-propan-2-yl-5-propan-2-yloxypyridine;2-propan-2-ylpyrazine;3-propan-2-ylpyridine;5-propan-2-ylpyridin-3-ol;5-propan-2-ylpyrimidine.
What is the SMILES notation for cumene;3-cyclopropyl-5-propan-2-ylpyridine;3-methoxy-5-propan-2-ylpyridine;4-(3-methylbutyl)morpholine;3-methyl-2-propan-2-ylpyridine;bis(3-methyl-5-propan-2-ylpyridine);4-methyl-2-propan-2-ylpyridine;2-methylpropylbenzene;2-methylpropylcyclopropane;2-(2-methylpropyl)pyridine;3-propan-2-yl-5-propan-2-yloxypyridine;2-propan-2-ylpyrazine;3-propan-2-ylpyridine;5-propan-2-ylpyridin-3-ol;5-propan-2-ylpyrimidine?
The canonical SMILES for cumene;3-cyclopropyl-5-propan-2-ylpyridine;3-methoxy-5-propan-2-ylpyridine;4-(3-methylbutyl)morpholine;3-methyl-2-propan-2-ylpyridine;bis(3-methyl-5-propan-2-ylpyridine);4-methyl-2-propan-2-ylpyridine;2-methylpropylbenzene;2-methylpropylcyclopropane;2-(2-methylpropyl)pyridine;3-propan-2-yl-5-propan-2-yloxypyridine;2-propan-2-ylpyrazine;3-propan-2-ylpyridine;5-propan-2-ylpyridin-3-ol;5-propan-2-ylpyrimidine is CC(C)CC1CC1.CC(C)CCN1CCOCC1.CC(C)Cc1ccccc1.CC(C)Cc1ccccn1.CC(C)Oc1cncc(C(C)C)c1.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1cccnc1.CC(C)c1cncc(C2CC2)c1.CC(C)c1cncc(O)c1.CC(C)c1cnccn1.CC(C)c1cncnc1.COc1cncc(C(C)C)c1.Cc1cccnc1C(C)C.Cc1ccnc(C(C)C)c1.Cc1cncc(C(C)C)c1.Cc1cncc(C(C)C)c1.
What is the InChIKey of cumene;3-cyclopropyl-5-propan-2-ylpyridine;3-methoxy-5-propan-2-ylpyridine;4-(3-methylbutyl)morpholine;3-methyl-2-propan-2-ylpyridine;bis(3-methyl-5-propan-2-ylpyridine);4-methyl-2-propan-2-ylpyridine;2-methylpropylbenzene;2-methylpropylcyclopropane;2-(2-methylpropyl)pyridine;3-propan-2-yl-5-propan-2-yloxypyridine;2-propan-2-ylpyrazine;3-propan-2-ylpyridine;5-propan-2-ylpyridin-3-ol;5-propan-2-ylpyrimidine?
The InChIKey is BJIJWKHMCREZEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO.C11H15N.C10H14.C9H13NO.C9H19NO.5C9H13N.2C9H12.C8H11NO.C8H11N.2C7H10N2.C7H14/c1-8(2)10-5-11(7-12-6-10)13-9(3)4;1-8(2)10-5-11(7-12-6-10)9-3-4-9;1-9(2)8-10-6-4-3-5-7-10;1-7(2)8-4-9(11-3)6-10-5-8;1-9(2)3-4-10-5-7-11-8-6-10;2*1-7(2)9-4-8(3)5-10-6-9;1-7(2)9-6-8(3)4-5-10-9;1-7(2)9-8(3)5-4-6-10-9;1-8(2)7-9-5-3-4-6-10-9;2*1-8(2)9-6-4-3-5-7-9;1-6(2)7-3-8(10)5-9-4-7;1-7(2)8-4-3-5-9-6-8;1-6(2)7-3-8-5-9-4-7;1-6(2)7-5-8-3-4-9-7;1-6(2)5-7-3-4-7/h5-9H,1-4H3;5-9H,3-4H2,1-2H3;3-7,9H,8H2,1-2H3;4-7H,1-3H3;9H,3-8H2,1-2H3;4*4-7H,1-3H3;3-6,8H,7H2,1-2H3;2*3-8H,1-2H3;3-6,10H,1-2H3;3-7H,1-2H3;2*3-6H,1-2H3;6-7H,3-5H2,1-2H3.
What are the key properties of cumene;3-cyclopropyl-5-propan-2-ylpyridine;3-methoxy-5-propan-2-ylpyridine;4-(3-methylbutyl)morpholine;3-methyl-2-propan-2-ylpyridine;bis(3-methyl-5-propan-2-ylpyridine);4-methyl-2-propan-2-ylpyridine;2-methylpropylbenzene;2-methylpropylcyclopropane;2-(2-methylpropyl)pyridine;3-propan-2-yl-5-propan-2-yloxypyridine;2-propan-2-ylpyrazine;3-propan-2-ylpyridine;5-propan-2-ylpyridin-3-ol;5-propan-2-ylpyrimidine?
cumene;3-cyclopropyl-5-propan-2-ylpyridine;3-methoxy-5-propan-2-ylpyridine;4-(3-methylbutyl)morpholine;3-methyl-2-propan-2-ylpyridine;bis(3-methyl-5-propan-2-ylpyridine);4-methyl-2-propan-2-ylpyridine;2-methylpropylbenzene;2-methylpropylcyclopropane;2-(2-methylpropyl)pyridine;3-propan-2-yl-5-propan-2-yloxypyridine;2-propan-2-ylpyrazine;3-propan-2-ylpyridine;5-propan-2-ylpyridin-3-ol;5-propan-2-ylpyrimidine has a molecular weight of 2300.53 g/mol, XLogP of 40.25, 26 rotatable bonds, 1 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for cumene;3-cyclopropyl-5-propan-2-ylpyridine;3-methoxy-5-propan-2-ylpyridine;4-(3-methylbutyl)morpholine;3-methyl-2-propan-2-ylpyridine;bis(3-methyl-5-propan-2-ylpyridine);4-methyl-2-propan-2-ylpyridine;2-methylpropylbenzene;2-methylpropylcyclopropane;2-(2-methylpropyl)pyridine;3-propan-2-yl-5-propan-2-yloxypyridine;2-propan-2-ylpyrazine;3-propan-2-ylpyridine;5-propan-2-ylpyridin-3-ol;5-propan-2-ylpyrimidine is sourced from PubChem (CID 157367277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).