2-butyl-6-methylpyridine;ethane;1-methyl-4-propylcyclohexane;N,N,2-trimethylquinazolin-4-amine

C33H54N4 — CID 142228214

IUPAC2-butyl-6-methylpyridine;ethane;1-methyl-4-propylcyclohexane;N,N,2-trimethylquinazolin-4-amine
SMILESCC.CCCC1CCC(C)CC1.CCCCc1cccc(C)n1.Cc1nc(N(C)C)c2ccccc2n1
InChIInChI=1S/C11H13N3.C10H15N.C10H20.C2H6/c1-8-12-10-7-5-4-6-9(10)11(13-8)14(2)3;1-3-4-7-10-8-5-6-9(2)11-10;1-3-4-10-7-5-9(2)6-8-10;1-2/h4-7H,1-3H3;5-6,8H,3-4,7H2,1-2H3;9-10H,3-8H2,1-2H3;1-2H3
InChIKeyKCYVDPQMYTZTIW-UHFFFAOYSA-N
MW506.82 g/mol
LogP9.38
Rot. Bonds6

About 2-butyl-6-methylpyridine;ethane;1-methyl-4-propylcyclohexane;N,N,2-trimethylquinazolin-4-amine

2-butyl-6-methylpyridine;ethane;1-methyl-4-propylcyclohexane;N,N,2-trimethylquinazolin-4-amine (PubChem CID 142228214) has the molecular formula C33H54N4 and a molecular weight of 506.82 g/mol. Its IUPAC name is 2-butyl-6-methylpyridine;ethane;1-methyl-4-propylcyclohexane;N,N,2-trimethylquinazolin-4-amine.

Molecular Properties

Compound Name2-butyl-6-methylpyridine;ethane;1-methyl-4-propylcyclohexane;N,N,2-trimethylquinazolin-4-amine
PubChem CID142228214
Molecular FormulaC33H54N4
Molecular Weight506.82 g/mol
Exact Mass506.43
IUPAC Name2-butyl-6-methylpyridine;ethane;1-methyl-4-propylcyclohexane;N,N,2-trimethylquinazolin-4-amine
SMILESCC.CCCC1CCC(C)CC1.CCCCc1cccc(C)n1.Cc1nc(N(C)C)c2ccccc2n1
InChIInChI=1S/C11H13N3.C10H15N.C10H20.C2H6/c1-8-12-10-7-5-4-6-9(10)11(13-8)14(2)3;1-3-4-7-10-8-5-6-9(2)11-10;1-3-4-10-7-5-9(2)6-8-10;1-2/h4-7H,1-3H3;5-6,8H,3-4,7H2,1-2H3;9-10H,3-8H2,1-2H3;1-2H3
InChIKeyKCYVDPQMYTZTIW-UHFFFAOYSA-N
XLogP9.38
TPSA41.91 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms37
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500506.82
LogP ≤ 59.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-butyl-6-methylpyridine;ethane;1-methyl-4-propylcyclohexane;N,N,2-trimethylquinazolin-4-amine with MolForge

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Launch Full Analysis

Related Compounds

1-methyl-4-propylcyclohexane;N,N,2-trimethylquinazolin-4-amine
CID 142230163
1,4-dimethylcyclohexane;ethylcyclopropane;N,N,2-trimethylquinazolin-4-amine
CID 142230066
N-[(Z)-1-chlorobutan-2-ylideneamino]-N-methylmethanamine;1,4-dipropylcyclohexane;N,N,2-trimethylquinazolin-4-amine
CID 142231303
(3Z,5E,8Z)-8-ethyl-5-fluoro-7-methyl-2,7-dihydro-1H-azonine;1-methyl-4-propylcyclohexane;N,N,2-trimethylquinazolin-4-amine
CID 142229145
1-(4-propylcyclohexyl)-N-(quinolin-4-ylmethyl)methanamine;N,N,2-trimethylquinazolin-4-amine
CID 142229295
1,4-dimethylcyclohexane;N,N,2-trimethylquinazolin-4-amine;4,4,4-tris(4-chlorophenyl)butan-2-one
CID 142228370
2-(2-bromophenyl)-N-[(4-methylcyclohexyl)methyl]acetamide;N,N,2-trimethylquinazolin-4-amine
CID 142230922
1,1-bis(4-chlorophenyl)propan-2-one;1,4-dimethylcyclohexane;ethane;N,N,2-trimethylquinazolin-4-amine
CID 142228930
4-[(4-methylcyclohexyl)methylamino]-1-phenylbutan-1-ol;N,N,2-trimethylquinazolin-4-amine
CID 142228945
1-cyclohexyl-N-[(4-methylcyclohexyl)methyl]methanamine;phenylmethanol;N,N,2-trimethylquinazolin-4-amine
CID 142229379
[2-[(4-methylcyclohexyl)methylamino]-2-oxo-1-phenylethyl] acetate;N,N,2-trimethylquinazolin-4-amine
CID 142229573
ethane;2-[4-(4-ethylcyclohexyl)butyl]-N,N-dimethylquinazolin-4-amine
CID 142229131

Frequently Asked Questions

What is the IUPAC name of 2-butyl-6-methylpyridine;ethane;1-methyl-4-propylcyclohexane;N,N,2-trimethylquinazolin-4-amine?
The IUPAC name of 2-butyl-6-methylpyridine;ethane;1-methyl-4-propylcyclohexane;N,N,2-trimethylquinazolin-4-amine (CID 142228214) is 2-butyl-6-methylpyridine;ethane;1-methyl-4-propylcyclohexane;N,N,2-trimethylquinazolin-4-amine.
What is the SMILES notation for 2-butyl-6-methylpyridine;ethane;1-methyl-4-propylcyclohexane;N,N,2-trimethylquinazolin-4-amine?
The canonical SMILES for 2-butyl-6-methylpyridine;ethane;1-methyl-4-propylcyclohexane;N,N,2-trimethylquinazolin-4-amine is CC.CCCC1CCC(C)CC1.CCCCc1cccc(C)n1.Cc1nc(N(C)C)c2ccccc2n1.
What is the InChIKey of 2-butyl-6-methylpyridine;ethane;1-methyl-4-propylcyclohexane;N,N,2-trimethylquinazolin-4-amine?
The InChIKey is KCYVDPQMYTZTIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3.C10H15N.C10H20.C2H6/c1-8-12-10-7-5-4-6-9(10)11(13-8)14(2)3;1-3-4-7-10-8-5-6-9(2)11-10;1-3-4-10-7-5-9(2)6-8-10;1-2/h4-7H,1-3H3;5-6,8H,3-4,7H2,1-2H3;9-10H,3-8H2,1-2H3;1-2H3.
What are the key properties of 2-butyl-6-methylpyridine;ethane;1-methyl-4-propylcyclohexane;N,N,2-trimethylquinazolin-4-amine?
2-butyl-6-methylpyridine;ethane;1-methyl-4-propylcyclohexane;N,N,2-trimethylquinazolin-4-amine has a molecular weight of 506.82 g/mol, XLogP of 9.38, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-6-methylpyridine;ethane;1-methyl-4-propylcyclohexane;N,N,2-trimethylquinazolin-4-amine is sourced from PubChem (CID 142228214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).