N-(cyclohexylmethyl)-N-methylpropan-2-amine;N-(cyclohexylmethyl)pent-1-en-2-amine;methane

C24H50N2 — CID 143467540

IUPACN-(cyclohexylmethyl)-N-methylpropan-2-amine;N-(cyclohexylmethyl)pent-1-en-2-amine;methane
SMILESC.C=C(CCC)NCC1CCCCC1.CC(C)N(C)CC1CCCCC1
InChIInChI=1S/C12H23N.C11H23N.CH4/c1-3-7-11(2)13-10-12-8-5-4-6-9-12;1-10(2)12(3)9-11-7-5-4-6-8-11;/h12-13H,2-10H2,1H3;10-11H,4-9H2,1-3H3;1H4
InChIKeyPHFGSYBWAPEKNV-UHFFFAOYSA-N
MW366.68 g/mol
LogP7.01
Rot. Bonds8

About N-(cyclohexylmethyl)-N-methylpropan-2-amine;N-(cyclohexylmethyl)pent-1-en-2-amine;methane

N-(cyclohexylmethyl)-N-methylpropan-2-amine;N-(cyclohexylmethyl)pent-1-en-2-amine;methane (PubChem CID 143467540) has the molecular formula C24H50N2 and a molecular weight of 366.68 g/mol. Its IUPAC name is N-(cyclohexylmethyl)-N-methylpropan-2-amine;N-(cyclohexylmethyl)pent-1-en-2-amine;methane.

Molecular Properties

Compound NameN-(cyclohexylmethyl)-N-methylpropan-2-amine;N-(cyclohexylmethyl)pent-1-en-2-amine;methane
PubChem CID143467540
Molecular FormulaC24H50N2
Molecular Weight366.68 g/mol
Exact Mass366.40
IUPAC NameN-(cyclohexylmethyl)-N-methylpropan-2-amine;N-(cyclohexylmethyl)pent-1-en-2-amine;methane
SMILESC.C=C(CCC)NCC1CCCCC1.CC(C)N(C)CC1CCCCC1
InChIInChI=1S/C12H23N.C11H23N.CH4/c1-3-7-11(2)13-10-12-8-5-4-6-9-12;1-10(2)12(3)9-11-7-5-4-6-8-11;/h12-13H,2-10H2,1H3;10-11H,4-9H2,1-3H3;1H4
InChIKeyPHFGSYBWAPEKNV-UHFFFAOYSA-N
XLogP7.01
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.68
LogP ≤ 57.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(cyclohexylmethyl)-N-methylpropan-2-amine
CID 18711540
N-(cyclooctylmethyl)-N'-methyl-N'-propan-2-ylethane-1,2-diamine
CID 114207737
2-[cyclohexylmethyl(methyl)amino]propan-1-ol
CID 115772276
N-(cyclohexylmethyl)-N'-methyl-N'-propan-2-ylpropane-1,3-diamine
CID 115581253
N-[(4-ethylcyclohexyl)methyl]-N-methylpropan-2-amine
CID 170952528
N-(cyclohexylmethyl)propan-2-amine;N,N-dimethylpropan-2-amine;methane;heptakis(N-methylpropan-2-amine)
CID 158956427
4-[cyclohexylmethyl(methyl)amino]pentanehydrazide
CID 63577696
3-(cyclooctylmethyl)-1-(cyclopropylmethyl)-1-ethylurea
CID 86940440
N-(cyclohexylmethyl)-1-iodo-N-methylethanamine
CID 154988433
1-N-cyclohexyl-2-N-(cyclohexylmethyl)-2-N-methylpropane-1,2-diamine
CID 62568908
1-N-butyl-2-N-(cyclohexylmethyl)-2-N-methylpropane-1,2-diamine
CID 62568386
N-(cyclohexylmethyl)-2-[(2-hydroxy-3-methoxypropyl)-methylamino]propanamide
CID 111462618

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)-N-methylpropan-2-amine;N-(cyclohexylmethyl)pent-1-en-2-amine;methane?
The IUPAC name of N-(cyclohexylmethyl)-N-methylpropan-2-amine;N-(cyclohexylmethyl)pent-1-en-2-amine;methane (CID 143467540) is N-(cyclohexylmethyl)-N-methylpropan-2-amine;N-(cyclohexylmethyl)pent-1-en-2-amine;methane.
What is the SMILES notation for N-(cyclohexylmethyl)-N-methylpropan-2-amine;N-(cyclohexylmethyl)pent-1-en-2-amine;methane?
The canonical SMILES for N-(cyclohexylmethyl)-N-methylpropan-2-amine;N-(cyclohexylmethyl)pent-1-en-2-amine;methane is C.C=C(CCC)NCC1CCCCC1.CC(C)N(C)CC1CCCCC1.
What is the InChIKey of N-(cyclohexylmethyl)-N-methylpropan-2-amine;N-(cyclohexylmethyl)pent-1-en-2-amine;methane?
The InChIKey is PHFGSYBWAPEKNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N.C11H23N.CH4/c1-3-7-11(2)13-10-12-8-5-4-6-9-12;1-10(2)12(3)9-11-7-5-4-6-8-11;/h12-13H,2-10H2,1H3;10-11H,4-9H2,1-3H3;1H4.
What are the key properties of N-(cyclohexylmethyl)-N-methylpropan-2-amine;N-(cyclohexylmethyl)pent-1-en-2-amine;methane?
N-(cyclohexylmethyl)-N-methylpropan-2-amine;N-(cyclohexylmethyl)pent-1-en-2-amine;methane has a molecular weight of 366.68 g/mol, XLogP of 7.01, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)-N-methylpropan-2-amine;N-(cyclohexylmethyl)pent-1-en-2-amine;methane is sourced from PubChem (CID 143467540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).