1-N,4-diethyl-2-N-methyl-2-N-(4-methylcyclohexyl)cyclohexane-1,2-diamine

C18H36N2 — CID 63468495

IUPAC1-N,4-diethyl-2-N-methyl-2-N-(4-methylcyclohexyl)cyclohexane-1,2-diamine
SMILESCCNC1CCC(CC)CC1N(C)C1CCC(C)CC1
InChIInChI=1S/C18H36N2/c1-5-15-9-12-17(19-6-2)18(13-15)20(4)16-10-7-14(3)8-11-16/h14-19H,5-13H2,1-4H3
InChIKeyZZWHLHYTTRQHJO-UHFFFAOYSA-N
MW280.50 g/mol
LogP4.05
Rot. Bonds5

About 1-N,4-diethyl-2-N-methyl-2-N-(4-methylcyclohexyl)cyclohexane-1,2-diamine

1-N,4-diethyl-2-N-methyl-2-N-(4-methylcyclohexyl)cyclohexane-1,2-diamine (PubChem CID 63468495) has the molecular formula C18H36N2 and a molecular weight of 280.50 g/mol. Its IUPAC name is 1-N,4-diethyl-2-N-methyl-2-N-(4-methylcyclohexyl)cyclohexane-1,2-diamine.

Molecular Properties

Compound Name1-N,4-diethyl-2-N-methyl-2-N-(4-methylcyclohexyl)cyclohexane-1,2-diamine
PubChem CID63468495
Molecular FormulaC18H36N2
Molecular Weight280.50 g/mol
Exact Mass280.29
IUPAC Name1-N,4-diethyl-2-N-methyl-2-N-(4-methylcyclohexyl)cyclohexane-1,2-diamine
SMILESCCNC1CCC(CC)CC1N(C)C1CCC(C)CC1
InChIInChI=1S/C18H36N2/c1-5-15-9-12-17(19-6-2)18(13-15)20(4)16-10-7-14(3)8-11-16/h14-19H,5-13H2,1-4H3
InChIKeyZZWHLHYTTRQHJO-UHFFFAOYSA-N
XLogP4.05
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.50
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

trans-(1S,2S)-2-N-cyclopropyl-1-N-ethyl-2-N-methylcyclohexane-1,2-diamine
CID 134438411
1-N-ethyl-3-N-(4-ethylcyclohexyl)-3-N-methylcyclopentane-1,3-diamine
CID 79642724
N,4-diethyl-2-[[methyl-(2-methylcyclohexyl)amino]methyl]cyclohexan-1-amine
CID 63493739
1-N,2-N,4-triethyl-2-N-(2-methylbutyl)cyclohexane-1,2-diamine
CID 79476839
2-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]-N,4-diethylcyclohexan-1-amine
CID 62611350
4-ethyl-2-N-methyl-2-N-(2-methylbutan-2-yl)-1-N-propylcyclohexane-1,2-diamine
CID 63983791
2-butyl-N,4-diethylcyclohexan-1-amine
CID 63403670
trans-(1R,3R)-1-ethyl-3-methylcyclopentane
CID 6432281
2-N-(4-ethylcyclohexyl)-1-N,2-N-dimethylcyclooctane-1,2-diamine
CID 63469418
2-decyl-N,4-diethylcyclohexan-1-amine
CID 63403278
4-ethyl-2-N-propan-2-yl-1-N,2-N-dipropylcyclohexane-1,2-diamine
CID 63464854
1-ethyl-3-methylcyclopentane;methane
CID 144878558

Frequently Asked Questions

What is the IUPAC name of 1-N,4-diethyl-2-N-methyl-2-N-(4-methylcyclohexyl)cyclohexane-1,2-diamine?
The IUPAC name of 1-N,4-diethyl-2-N-methyl-2-N-(4-methylcyclohexyl)cyclohexane-1,2-diamine (CID 63468495) is 1-N,4-diethyl-2-N-methyl-2-N-(4-methylcyclohexyl)cyclohexane-1,2-diamine.
What is the SMILES notation for 1-N,4-diethyl-2-N-methyl-2-N-(4-methylcyclohexyl)cyclohexane-1,2-diamine?
The canonical SMILES for 1-N,4-diethyl-2-N-methyl-2-N-(4-methylcyclohexyl)cyclohexane-1,2-diamine is CCNC1CCC(CC)CC1N(C)C1CCC(C)CC1.
What is the InChIKey of 1-N,4-diethyl-2-N-methyl-2-N-(4-methylcyclohexyl)cyclohexane-1,2-diamine?
The InChIKey is ZZWHLHYTTRQHJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36N2/c1-5-15-9-12-17(19-6-2)18(13-15)20(4)16-10-7-14(3)8-11-16/h14-19H,5-13H2,1-4H3.
What are the key properties of 1-N,4-diethyl-2-N-methyl-2-N-(4-methylcyclohexyl)cyclohexane-1,2-diamine?
1-N,4-diethyl-2-N-methyl-2-N-(4-methylcyclohexyl)cyclohexane-1,2-diamine has a molecular weight of 280.50 g/mol, XLogP of 4.05, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,4-diethyl-2-N-methyl-2-N-(4-methylcyclohexyl)cyclohexane-1,2-diamine is sourced from PubChem (CID 63468495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).