4-ethyl-N-(1-phenylpropyl)cyclohexan-1-amine

C17H27N — CID 55194080

IUPAC4-ethyl-N-(1-phenylpropyl)cyclohexan-1-amine
SMILESCCC1CCC(NC(CC)c2ccccc2)CC1
InChIInChI=1S/C17H27N/c1-3-14-10-12-16(13-11-14)18-17(4-2)15-8-6-5-7-9-15/h5-9,14,16-18H,3-4,10-13H2,1-2H3
InChIKeyISGGUYKDCNJMTH-UHFFFAOYSA-N
MW245.41 g/mol
LogP4.70
Rot. Bonds5

About 4-ethyl-N-(1-phenylpropyl)cyclohexan-1-amine

4-ethyl-N-(1-phenylpropyl)cyclohexan-1-amine (PubChem CID 55194080) has the molecular formula C17H27N and a molecular weight of 245.41 g/mol. Its IUPAC name is 4-ethyl-N-(1-phenylpropyl)cyclohexan-1-amine.

Molecular Properties

Compound Name4-ethyl-N-(1-phenylpropyl)cyclohexan-1-amine
PubChem CID55194080
Molecular FormulaC17H27N
Molecular Weight245.41 g/mol
Exact Mass245.21
IUPAC Name4-ethyl-N-(1-phenylpropyl)cyclohexan-1-amine
SMILESCCC1CCC(NC(CC)c2ccccc2)CC1
InChIInChI=1S/C17H27N/c1-3-14-10-12-16(13-11-14)18-17(4-2)15-8-6-5-7-9-15/h5-9,14,16-18H,3-4,10-13H2,1-2H3
InChIKeyISGGUYKDCNJMTH-UHFFFAOYSA-N
XLogP4.70
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.41
LogP ≤ 54.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[1-(4-bromophenyl)propyl]-4-ethylcyclohexan-1-amine
CID 43223922
2-[(3-ethylcyclopentyl)amino]-2-phenylethanol
CID 64500919
N-[1-(3,4-dichlorophenyl)propyl]-4-ethylcyclohexan-1-amine
CID 63454246
4-ethyl-N-(2-methyl-1-phenylpropyl)cycloheptan-1-amine
CID 65083894
N-(1-phenylpropyl)-1-propan-2-ylpiperidin-4-amine
CID 43206638
N-(1-phenylpropyl)oxetan-3-amine
CID 63624948
3-methylsulfanyl-N-(1-phenylpropyl)cyclohexan-1-amine
CID 103784503
N-[(1R)-1-(4-bromophenyl)propyl]cyclopropanamine
CID 30081048
(2S)-2-(cyclopropylamino)-2-phenylethanol
CID 93471499
4-N-(3-methyl-1-phenylbutyl)cyclohexane-1,4-diamine
CID 62313676
4-N-(1-phenylpentyl)cyclohexane-1,4-diamine
CID 62319614
3-methylsulfonyl-N-(1-phenylpropyl)cyclohexan-1-amine
CID 79002828

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-(1-phenylpropyl)cyclohexan-1-amine?
The IUPAC name of 4-ethyl-N-(1-phenylpropyl)cyclohexan-1-amine (CID 55194080) is 4-ethyl-N-(1-phenylpropyl)cyclohexan-1-amine.
What is the SMILES notation for 4-ethyl-N-(1-phenylpropyl)cyclohexan-1-amine?
The canonical SMILES for 4-ethyl-N-(1-phenylpropyl)cyclohexan-1-amine is CCC1CCC(NC(CC)c2ccccc2)CC1.
What is the InChIKey of 4-ethyl-N-(1-phenylpropyl)cyclohexan-1-amine?
The InChIKey is ISGGUYKDCNJMTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N/c1-3-14-10-12-16(13-11-14)18-17(4-2)15-8-6-5-7-9-15/h5-9,14,16-18H,3-4,10-13H2,1-2H3.
What are the key properties of 4-ethyl-N-(1-phenylpropyl)cyclohexan-1-amine?
4-ethyl-N-(1-phenylpropyl)cyclohexan-1-amine has a molecular weight of 245.41 g/mol, XLogP of 4.70, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-(1-phenylpropyl)cyclohexan-1-amine is sourced from PubChem (CID 55194080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).