N'-(2-cyclohexylethyl)ethane-1,2-diamine

C10H22N2 — CID 14775339

IUPACN'-(2-cyclohexylethyl)ethane-1,2-diamine
SMILESNCCNCCC1CCCCC1
InChIInChI=1S/C10H22N2/c11-7-9-12-8-6-10-4-2-1-3-5-10/h10,12H,1-9,11H2
InChIKeyZKITVQQJRMZDBV-UHFFFAOYSA-N
MW170.30 g/mol
LogP1.51
Rot. Bonds5

About N'-(2-cyclohexylethyl)ethane-1,2-diamine

N'-(2-cyclohexylethyl)ethane-1,2-diamine (PubChem CID 14775339) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is N'-(2-cyclohexylethyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-(2-cyclohexylethyl)ethane-1,2-diamine
PubChem CID14775339
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC NameN'-(2-cyclohexylethyl)ethane-1,2-diamine
SMILESNCCNCCC1CCCCC1
InChIInChI=1S/C10H22N2/c11-7-9-12-8-6-10-4-2-1-3-5-10/h10,12H,1-9,11H2
InChIKeyZKITVQQJRMZDBV-UHFFFAOYSA-N
XLogP1.51
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

(2-Cyclohexylethyl)(methyl)amine
CID 43930
(5-Cyclohexyl-pentyl)-methyl-amine
CID 18790250
(Cyclohexylmethyl)(methyl)amine
CID 117276
1-(Cyclohexylmethyl)piperazine
CID 2735885
4-cyclohexylbutyl-[(1R)-2-methyl-1-[[[(1S)-1-(methylaminomethyl)pentyl]amino]methyl]propyl]amine
CID 24793490
(2-Amino-1-cyclohexylethyl)dimethylamine
CID 16228005
(Cyclohexylmethyl)(propyl)amine
CID 551629
Cyclohexane, aminoethylaminomethyl-
CID 57155025
1-(2-Cyclohexylethyl)piperazine
CID 2735884
1-(aminomethyl)-N-methylcyclohexan-1-amine
CID 14088188
1-(Cyclohexylmethyl)-1,4-diazepane
CID 24702363
[(2S)-2-amino-2-cyclohexylethyl]dimethylamine
CID 58598201

Frequently Asked Questions

What is the IUPAC name of N'-(2-cyclohexylethyl)ethane-1,2-diamine?
The IUPAC name of N'-(2-cyclohexylethyl)ethane-1,2-diamine (CID 14775339) is N'-(2-cyclohexylethyl)ethane-1,2-diamine.
What is the SMILES notation for N'-(2-cyclohexylethyl)ethane-1,2-diamine?
The canonical SMILES for N'-(2-cyclohexylethyl)ethane-1,2-diamine is NCCNCCC1CCCCC1.
What is the InChIKey of N'-(2-cyclohexylethyl)ethane-1,2-diamine?
The InChIKey is ZKITVQQJRMZDBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2/c11-7-9-12-8-6-10-4-2-1-3-5-10/h10,12H,1-9,11H2.
What are the key properties of N'-(2-cyclohexylethyl)ethane-1,2-diamine?
N'-(2-cyclohexylethyl)ethane-1,2-diamine has a molecular weight of 170.30 g/mol, XLogP of 1.51, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-cyclohexylethyl)ethane-1,2-diamine is sourced from PubChem (CID 14775339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).