1-N,1-N-dicyclohexyl-2-N-ethylpropane-1,2-diamine

C17H34N2 — CID 55134210

IUPAC1-N,1-N-dicyclohexyl-2-N-ethylpropane-1,2-diamine
SMILESCCNC(C)CN(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C17H34N2/c1-3-18-15(2)14-19(16-10-6-4-7-11-16)17-12-8-5-9-13-17/h15-18H,3-14H2,1-2H3
InChIKeySBQGULKKCJIHLC-UHFFFAOYSA-N
MW266.47 g/mol
LogP3.95
Rot. Bonds6

About 1-N,1-N-dicyclohexyl-2-N-ethylpropane-1,2-diamine

1-N,1-N-dicyclohexyl-2-N-ethylpropane-1,2-diamine (PubChem CID 55134210) has the molecular formula C17H34N2 and a molecular weight of 266.47 g/mol. Its IUPAC name is 1-N,1-N-dicyclohexyl-2-N-ethylpropane-1,2-diamine.

Molecular Properties

Compound Name1-N,1-N-dicyclohexyl-2-N-ethylpropane-1,2-diamine
PubChem CID55134210
Molecular FormulaC17H34N2
Molecular Weight266.47 g/mol
Exact Mass266.27
IUPAC Name1-N,1-N-dicyclohexyl-2-N-ethylpropane-1,2-diamine
SMILESCCNC(C)CN(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C17H34N2/c1-3-18-15(2)14-19(16-10-6-4-7-11-16)17-12-8-5-9-13-17/h15-18H,3-14H2,1-2H3
InChIKeySBQGULKKCJIHLC-UHFFFAOYSA-N
XLogP3.95
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.47
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N',N'-dicyclohexyl-1-cyclopropyl-N-methylethane-1,2-diamine
CID 63915367
4-cyclohexyl-N-ethylpentan-2-amine
CID 64718542
2-N-ethyl-1-N,1-N-dimethylpropane-1,2-diamine
CID 23008779
N'-cyclohexyl-1-cyclopropyl-N,N'-diethylethane-1,2-diamine
CID 63912315
4-[cycloheptyl(methyl)amino]-3-(ethylamino)butan-1-ol
CID 64897532
2-N-(cyclohexylmethyl)-1-N-ethyl-1-N-methylpropane-1,2-diamine
CID 103109993
1-N,1-N-di(cyclobutyl)-2-N-cyclopentylpentane-1,2-diamine
CID 166972958
N-butan-2-yl-N'-cycloheptyl-N'-methylethane-1,2-diamine
CID 60853944
1-cyclopentyl-N-ethylethanamine
CID 60819244
1-cyclohexyl-N'-cyclopropyl-N,N'-diethylethane-1,2-diamine
CID 104744610
1-[2-(ethylamino)propyl]-N,N-dimethylpyrrolidin-3-amine
CID 63164255
2-N-ethyl-4-N-methyl-4-N-(2-methylcyclohexyl)pentane-2,4-diamine
CID 64706595

Frequently Asked Questions

What is the IUPAC name of 1-N,1-N-dicyclohexyl-2-N-ethylpropane-1,2-diamine?
The IUPAC name of 1-N,1-N-dicyclohexyl-2-N-ethylpropane-1,2-diamine (CID 55134210) is 1-N,1-N-dicyclohexyl-2-N-ethylpropane-1,2-diamine.
What is the SMILES notation for 1-N,1-N-dicyclohexyl-2-N-ethylpropane-1,2-diamine?
The canonical SMILES for 1-N,1-N-dicyclohexyl-2-N-ethylpropane-1,2-diamine is CCNC(C)CN(C1CCCCC1)C1CCCCC1.
What is the InChIKey of 1-N,1-N-dicyclohexyl-2-N-ethylpropane-1,2-diamine?
The InChIKey is SBQGULKKCJIHLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-3-18-15(2)14-19(16-10-6-4-7-11-16)17-12-8-5-9-13-17/h15-18H,3-14H2,1-2H3.
What are the key properties of 1-N,1-N-dicyclohexyl-2-N-ethylpropane-1,2-diamine?
1-N,1-N-dicyclohexyl-2-N-ethylpropane-1,2-diamine has a molecular weight of 266.47 g/mol, XLogP of 3.95, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,1-N-dicyclohexyl-2-N-ethylpropane-1,2-diamine is sourced from PubChem (CID 55134210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).