3-N-cyclohexyl-1-N-ethyl-3-N-methylcyclopentane-1,3-diamine

C14H28N2 — CID 79642460

IUPAC3-N-cyclohexyl-1-N-ethyl-3-N-methylcyclopentane-1,3-diamine
SMILESCCNC1CCC(N(C)C2CCCCC2)C1
InChIInChI=1S/C14H28N2/c1-3-15-12-9-10-14(11-12)16(2)13-7-5-4-6-8-13/h12-15H,3-11H2,1-2H3
InChIKeyOQILQZNSUCIJDO-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.78
Rot. Bonds4

About 3-N-cyclohexyl-1-N-ethyl-3-N-methylcyclopentane-1,3-diamine

3-N-cyclohexyl-1-N-ethyl-3-N-methylcyclopentane-1,3-diamine (PubChem CID 79642460) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is 3-N-cyclohexyl-1-N-ethyl-3-N-methylcyclopentane-1,3-diamine.

Molecular Properties

Compound Name3-N-cyclohexyl-1-N-ethyl-3-N-methylcyclopentane-1,3-diamine
PubChem CID79642460
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name3-N-cyclohexyl-1-N-ethyl-3-N-methylcyclopentane-1,3-diamine
SMILESCCNC1CCC(N(C)C2CCCCC2)C1
InChIInChI=1S/C14H28N2/c1-3-15-12-9-10-14(11-12)16(2)13-7-5-4-6-8-13/h12-15H,3-11H2,1-2H3
InChIKeyOQILQZNSUCIJDO-UHFFFAOYSA-N
XLogP2.78
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Launch Full Analysis

Related Compounds

3-N-cyclopentyl-1-N-ethyl-3-N-methylcyclopentane-1,3-diamine
CID 79644118
1-N-ethyl-3-N-(4-ethylcyclohexyl)-3-N-methylcyclopentane-1,3-diamine
CID 79642724
3-N-cyclopropyl-3-N-methyl-1-N-propylcyclopentane-1,3-diamine
CID 79643528
1-N-cyclohexyl-1-N,3-N-diethylcyclohexane-1,3-diamine
CID 79630666
4-N-cyclooctyl-1-N,4-N-dimethylcyclohexane-1,4-diamine
CID 79122769
N-cyclopropyl-N-methylcyclooctanamine
CID 67119180
N-cyclopropyl-N-methylcyclohexanamine;hydrochloride
CID 67002847
N-cyclobutyl-N-methylcyclohexanamine
CID 90984290
1-N-ethyl-3-N-methyl-3-N-(3-methylbutan-2-yl)cyclopentane-1,3-diamine
CID 79643301
4-N-(3-ethylcyclohexyl)-1-N,4-N-dimethylcyclohexane-1,4-diamine
CID 79122835
3-N-methyl-3-N-(1-methylpiperidin-4-yl)-1-N-propylcyclopentane-1,3-diamine
CID 79642701
3-N-methyl-3-N-(2-methylcyclohexyl)-1-N-propylcyclopentane-1,3-diamine
CID 79642486

Frequently Asked Questions

What is the IUPAC name of 3-N-cyclohexyl-1-N-ethyl-3-N-methylcyclopentane-1,3-diamine?
The IUPAC name of 3-N-cyclohexyl-1-N-ethyl-3-N-methylcyclopentane-1,3-diamine (CID 79642460) is 3-N-cyclohexyl-1-N-ethyl-3-N-methylcyclopentane-1,3-diamine.
What is the SMILES notation for 3-N-cyclohexyl-1-N-ethyl-3-N-methylcyclopentane-1,3-diamine?
The canonical SMILES for 3-N-cyclohexyl-1-N-ethyl-3-N-methylcyclopentane-1,3-diamine is CCNC1CCC(N(C)C2CCCCC2)C1.
What is the InChIKey of 3-N-cyclohexyl-1-N-ethyl-3-N-methylcyclopentane-1,3-diamine?
The InChIKey is OQILQZNSUCIJDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-3-15-12-9-10-14(11-12)16(2)13-7-5-4-6-8-13/h12-15H,3-11H2,1-2H3.
What are the key properties of 3-N-cyclohexyl-1-N-ethyl-3-N-methylcyclopentane-1,3-diamine?
3-N-cyclohexyl-1-N-ethyl-3-N-methylcyclopentane-1,3-diamine has a molecular weight of 224.39 g/mol, XLogP of 2.78, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-cyclohexyl-1-N-ethyl-3-N-methylcyclopentane-1,3-diamine is sourced from PubChem (CID 79642460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).