2-N,4-diethyl-2-N-(2-ethylbutyl)-1-N-propylcyclohexane-1,2-diamine

C19H40N2 — CID 63468498

IUPAC2-N,4-diethyl-2-N-(2-ethylbutyl)-1-N-propylcyclohexane-1,2-diamine
SMILESCCCNC1CCC(CC)CC1N(CC)CC(CC)CC
InChIInChI=1S/C19H40N2/c1-6-13-20-18-12-11-17(9-4)14-19(18)21(10-5)15-16(7-2)8-3/h16-20H,6-15H2,1-5H3
InChIKeyUCXGTJXWDJWSCN-UHFFFAOYSA-N
MW296.54 g/mol
LogP4.69
Rot. Bonds10

About 2-N,4-diethyl-2-N-(2-ethylbutyl)-1-N-propylcyclohexane-1,2-diamine

2-N,4-diethyl-2-N-(2-ethylbutyl)-1-N-propylcyclohexane-1,2-diamine (PubChem CID 63468498) has the molecular formula C19H40N2 and a molecular weight of 296.54 g/mol. Its IUPAC name is 2-N,4-diethyl-2-N-(2-ethylbutyl)-1-N-propylcyclohexane-1,2-diamine.

Molecular Properties

Compound Name2-N,4-diethyl-2-N-(2-ethylbutyl)-1-N-propylcyclohexane-1,2-diamine
PubChem CID63468498
Molecular FormulaC19H40N2
Molecular Weight296.54 g/mol
Exact Mass296.32
IUPAC Name2-N,4-diethyl-2-N-(2-ethylbutyl)-1-N-propylcyclohexane-1,2-diamine
SMILESCCCNC1CCC(CC)CC1N(CC)CC(CC)CC
InChIInChI=1S/C19H40N2/c1-6-13-20-18-12-11-17(9-4)14-19(18)21(10-5)15-16(7-2)8-3/h16-20H,6-15H2,1-5H3
InChIKeyUCXGTJXWDJWSCN-UHFFFAOYSA-N
XLogP4.69
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.54
LogP ≤ 54.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-N,2-N,4-triethyl-2-N-(2-methylbutyl)cyclohexane-1,2-diamine
CID 79476839
4-ethyl-2-N-(2-methoxyethyl)-2-N-(2-methylpropyl)-1-N-propylcyclohexane-1,2-diamine
CID 63467792
4-ethyl-2-N-propan-2-yl-1-N,2-N-dipropylcyclohexane-1,2-diamine
CID 63464854
4-ethyl-2-N-methyl-2-N-(2-methylbutan-2-yl)-1-N-propylcyclohexane-1,2-diamine
CID 63983791
1-N-ethyl-1-N-(2-ethylbutyl)-3-N-propylcyclohexane-1,3-diamine
CID 79631157
4-ethyl-2-N-pentyl-2-N-propan-2-yl-1-N-propylcyclohexane-1,2-diamine
CID 63469963
2-N-ethyl-2-N-(2-methylpropyl)-1-N-propylcyclooctane-1,2-diamine
CID 63467359
2-N-butyl-2-N-ethyl-4-methyl-1-N-propylcyclohexane-1,2-diamine
CID 63466576
4-ethyl-2-[[ethyl(propyl)amino]methyl]-N-propylcyclohexan-1-amine
CID 63483081
2-[[cyclopropyl(propyl)amino]methyl]-4-ethyl-N-propylcyclohexan-1-amine
CID 63484004
2-(2-ethylbutyl)-N,4-dipropylcyclohexan-1-amine
CID 82929498
2-N-(cyclobutylmethyl)-2-N-ethyl-1-N-propylcyclohexane-1,2-diamine
CID 107397961

Frequently Asked Questions

What is the IUPAC name of 2-N,4-diethyl-2-N-(2-ethylbutyl)-1-N-propylcyclohexane-1,2-diamine?
The IUPAC name of 2-N,4-diethyl-2-N-(2-ethylbutyl)-1-N-propylcyclohexane-1,2-diamine (CID 63468498) is 2-N,4-diethyl-2-N-(2-ethylbutyl)-1-N-propylcyclohexane-1,2-diamine.
What is the SMILES notation for 2-N,4-diethyl-2-N-(2-ethylbutyl)-1-N-propylcyclohexane-1,2-diamine?
The canonical SMILES for 2-N,4-diethyl-2-N-(2-ethylbutyl)-1-N-propylcyclohexane-1,2-diamine is CCCNC1CCC(CC)CC1N(CC)CC(CC)CC.
What is the InChIKey of 2-N,4-diethyl-2-N-(2-ethylbutyl)-1-N-propylcyclohexane-1,2-diamine?
The InChIKey is UCXGTJXWDJWSCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H40N2/c1-6-13-20-18-12-11-17(9-4)14-19(18)21(10-5)15-16(7-2)8-3/h16-20H,6-15H2,1-5H3.
What are the key properties of 2-N,4-diethyl-2-N-(2-ethylbutyl)-1-N-propylcyclohexane-1,2-diamine?
2-N,4-diethyl-2-N-(2-ethylbutyl)-1-N-propylcyclohexane-1,2-diamine has a molecular weight of 296.54 g/mol, XLogP of 4.69, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,4-diethyl-2-N-(2-ethylbutyl)-1-N-propylcyclohexane-1,2-diamine is sourced from PubChem (CID 63468498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).