2-ethyl-N-(4-phenylcyclohexyl)cyclohexan-1-amine

C20H31N — CID 43434154

IUPAC2-ethyl-N-(4-phenylcyclohexyl)cyclohexan-1-amine
SMILESCCC1CCCCC1NC1CCC(c2ccccc2)CC1
InChIInChI=1S/C20H31N/c1-2-16-8-6-7-11-20(16)21-19-14-12-18(13-15-19)17-9-4-3-5-10-17/h3-5,9-10,16,18-21H,2,6-8,11-15H2,1H3
InChIKeyQILZNIVWJYKWPK-UHFFFAOYSA-N
MW285.47 g/mol
LogP5.27
Rot. Bonds4

About 2-ethyl-N-(4-phenylcyclohexyl)cyclohexan-1-amine

2-ethyl-N-(4-phenylcyclohexyl)cyclohexan-1-amine (PubChem CID 43434154) has the molecular formula C20H31N and a molecular weight of 285.47 g/mol. Its IUPAC name is 2-ethyl-N-(4-phenylcyclohexyl)cyclohexan-1-amine.

Molecular Properties

Compound Name2-ethyl-N-(4-phenylcyclohexyl)cyclohexan-1-amine
PubChem CID43434154
Molecular FormulaC20H31N
Molecular Weight285.47 g/mol
Exact Mass285.25
IUPAC Name2-ethyl-N-(4-phenylcyclohexyl)cyclohexan-1-amine
SMILESCCC1CCCCC1NC1CCC(c2ccccc2)CC1
InChIInChI=1S/C20H31N/c1-2-16-8-6-7-11-20(16)21-19-14-12-18(13-15-19)17-9-4-3-5-10-17/h3-5,9-10,16,18-21H,2,6-8,11-15H2,1H3
InChIKeyQILZNIVWJYKWPK-UHFFFAOYSA-N
XLogP5.27
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500285.47
LogP ≤ 55.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-ethyl-N-(2-phenylcyclohexyl)cyclohexan-1-amine
CID 43784317
N-[(4-cyclopropylphenyl)methyl]-2-ethylcyclohexan-1-amine
CID 79979070
N-benzyl-2-ethylcyclohexan-1-amine
CID 43434056
N-(2,3-dimethylcyclopentyl)-4-phenylcyclohexan-1-amine
CID 64908026
N-(2-ethylcyclohexyl)oxan-4-amine
CID 43709257
2-methyl-N-(4-phenylcyclohexyl)thiolan-3-amine
CID 102672829
4-N-(4-phenylcyclohexyl)cyclohexane-1,4-diamine
CID 62314935
2-ethyl-N-(2-ethylcyclopropyl)cyclohexan-1-amine
CID 103960948
cyclopropylbenzene;ethylhydrazine
CID 22346635
2-methyl-N-(3-phenylcyclobutyl)cyclohexan-1-amine
CID 43632161
CID 159076923
CID 159076923
1-methyl-N-(4-phenylcyclohexyl)piperidin-4-amine
CID 43215929

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-(4-phenylcyclohexyl)cyclohexan-1-amine?
The IUPAC name of 2-ethyl-N-(4-phenylcyclohexyl)cyclohexan-1-amine (CID 43434154) is 2-ethyl-N-(4-phenylcyclohexyl)cyclohexan-1-amine.
What is the SMILES notation for 2-ethyl-N-(4-phenylcyclohexyl)cyclohexan-1-amine?
The canonical SMILES for 2-ethyl-N-(4-phenylcyclohexyl)cyclohexan-1-amine is CCC1CCCCC1NC1CCC(c2ccccc2)CC1.
What is the InChIKey of 2-ethyl-N-(4-phenylcyclohexyl)cyclohexan-1-amine?
The InChIKey is QILZNIVWJYKWPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H31N/c1-2-16-8-6-7-11-20(16)21-19-14-12-18(13-15-19)17-9-4-3-5-10-17/h3-5,9-10,16,18-21H,2,6-8,11-15H2,1H3.
What are the key properties of 2-ethyl-N-(4-phenylcyclohexyl)cyclohexan-1-amine?
2-ethyl-N-(4-phenylcyclohexyl)cyclohexan-1-amine has a molecular weight of 285.47 g/mol, XLogP of 5.27, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-(4-phenylcyclohexyl)cyclohexan-1-amine is sourced from PubChem (CID 43434154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).