1-cyclohexyl-N-(2-phenylethyl)ethane-1,2-diamine

C16H26N2 — CID 57365235

IUPAC1-cyclohexyl-N-(2-phenylethyl)ethane-1,2-diamine
SMILESNCC(NCCc1ccccc1)C1CCCCC1
InChIInChI=1S/C16H26N2/c17-13-16(15-9-5-2-6-10-15)18-12-11-14-7-3-1-4-8-14/h1,3-4,7-8,15-16,18H,2,5-6,9-13,17H2
InChIKeyANLPNFLZJGJBJW-UHFFFAOYSA-N
MW246.40 g/mol
LogP2.73
Rot. Bonds6

About 1-cyclohexyl-N-(2-phenylethyl)ethane-1,2-diamine

1-cyclohexyl-N-(2-phenylethyl)ethane-1,2-diamine (PubChem CID 57365235) has the molecular formula C16H26N2 and a molecular weight of 246.40 g/mol. Its IUPAC name is 1-cyclohexyl-N-(2-phenylethyl)ethane-1,2-diamine.

Molecular Properties

Compound Name1-cyclohexyl-N-(2-phenylethyl)ethane-1,2-diamine
PubChem CID57365235
Molecular FormulaC16H26N2
Molecular Weight246.40 g/mol
Exact Mass246.21
IUPAC Name1-cyclohexyl-N-(2-phenylethyl)ethane-1,2-diamine
SMILESNCC(NCCc1ccccc1)C1CCCCC1
InChIInChI=1S/C16H26N2/c17-13-16(15-9-5-2-6-10-15)18-12-11-14-7-3-1-4-8-14/h1,3-4,7-8,15-16,18H,2,5-6,9-13,17H2
InChIKeyANLPNFLZJGJBJW-UHFFFAOYSA-N
XLogP2.73
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.40
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-amino-1-cyclohexylethyl)-3-phenylpropanamide;hydrochloride
CID 119260925
(1-cyclohexyl-3-phenylpropyl)hydrazine
CID 105201730
1-cyclopentyl-N-phenylethane-1,2-diamine
CID 65380108
(1-cyclooctyl-2-phenylethyl)hydrazine
CID 105254972
(1-cyclobutyl-3-phenylpropyl)hydrazine
CID 105205787
1-cycloheptyl-3-phenylpropan-1-amine
CID 65399790
1-cyclopropyl-N-(2-phenylethyl)ethanamine
CID 43178582
methyl (2S)-2-[[(1S)-1-cyclohexyl-3-phenylpropyl]amino]-3-methylbutanoate
CID 101455107
N-(2-amino-1-cyclohexylethyl)benzenesulfonamide
CID 61122381
3,3-dicyclohexylpropylbenzene
CID 86671113
1-cyclobutyl-N-(2-phenylethyl)propan-2-amine
CID 115705957
N,N-dibenzyl-1-cyclopentylethane-1,2-diamine
CID 130158926

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N-(2-phenylethyl)ethane-1,2-diamine?
The IUPAC name of 1-cyclohexyl-N-(2-phenylethyl)ethane-1,2-diamine (CID 57365235) is 1-cyclohexyl-N-(2-phenylethyl)ethane-1,2-diamine.
What is the SMILES notation for 1-cyclohexyl-N-(2-phenylethyl)ethane-1,2-diamine?
The canonical SMILES for 1-cyclohexyl-N-(2-phenylethyl)ethane-1,2-diamine is NCC(NCCc1ccccc1)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-N-(2-phenylethyl)ethane-1,2-diamine?
The InChIKey is ANLPNFLZJGJBJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2/c17-13-16(15-9-5-2-6-10-15)18-12-11-14-7-3-1-4-8-14/h1,3-4,7-8,15-16,18H,2,5-6,9-13,17H2.
What are the key properties of 1-cyclohexyl-N-(2-phenylethyl)ethane-1,2-diamine?
1-cyclohexyl-N-(2-phenylethyl)ethane-1,2-diamine has a molecular weight of 246.40 g/mol, XLogP of 2.73, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-(2-phenylethyl)ethane-1,2-diamine is sourced from PubChem (CID 57365235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).