1-(5-ethyl-2-methylphenyl)cyclohexan-1-amine

C15H23N — CID 117310158

IUPAC1-(5-ethyl-2-methylphenyl)cyclohexan-1-amine
SMILESCCc1ccc(C)c(C2(N)CCCCC2)c1
InChIInChI=1S/C15H23N/c1-3-13-8-7-12(2)14(11-13)15(16)9-5-4-6-10-15/h7-8,11H,3-6,9-10,16H2,1-2H3
InChIKeyADZYICXDPCDMPD-UHFFFAOYSA-N
MW217.36 g/mol
LogP3.68
Rot. Bonds2

About 1-(5-ethyl-2-methylphenyl)cyclohexan-1-amine

1-(5-ethyl-2-methylphenyl)cyclohexan-1-amine (PubChem CID 117310158) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is 1-(5-ethyl-2-methylphenyl)cyclohexan-1-amine.

Molecular Properties

Compound Name1-(5-ethyl-2-methylphenyl)cyclohexan-1-amine
PubChem CID117310158
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC Name1-(5-ethyl-2-methylphenyl)cyclohexan-1-amine
SMILESCCc1ccc(C)c(C2(N)CCCCC2)c1
InChIInChI=1S/C15H23N/c1-3-13-8-7-12(2)14(11-13)15(16)9-5-4-6-10-15/h7-8,11H,3-6,9-10,16H2,1-2H3
InChIKeyADZYICXDPCDMPD-UHFFFAOYSA-N
XLogP3.68
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-Phenylcyclohexylamine
CID 31862
1-(1-Naphthyl)ethylamine
CID 98089
Cyclohexanamine, 1-phenyl-, hydrochloride (1:1)
CID 200391
2,5-Dimethylbenzeneethanamine
CID 211415
Pentorex
CID 22031
1-(4-Fluorophenyl)cyclohexan-1-amine
CID 24274287
1-(3-Fluorophenyl)cyclohexan-1-amine hydrochloride
CID 45259864
1-(Naphthalen-2-yl)ethan-1-amine
CID 3857145
2,5-Dimethylbenzylamine
CID 66735
1-(3-Methylphenyl)cyclohexan-1-amine hydrochloride
CID 45259751
[3-(3-Methylphenyl)phenyl]methanamine
CID 1392314
1-{3'-Methyl-[1,1'-biphenyl]-4-yl}methanamine
CID 1393977

Frequently Asked Questions

What is the IUPAC name of 1-(5-ethyl-2-methylphenyl)cyclohexan-1-amine?
The IUPAC name of 1-(5-ethyl-2-methylphenyl)cyclohexan-1-amine (CID 117310158) is 1-(5-ethyl-2-methylphenyl)cyclohexan-1-amine.
What is the SMILES notation for 1-(5-ethyl-2-methylphenyl)cyclohexan-1-amine?
The canonical SMILES for 1-(5-ethyl-2-methylphenyl)cyclohexan-1-amine is CCc1ccc(C)c(C2(N)CCCCC2)c1.
What is the InChIKey of 1-(5-ethyl-2-methylphenyl)cyclohexan-1-amine?
The InChIKey is ADZYICXDPCDMPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c1-3-13-8-7-12(2)14(11-13)15(16)9-5-4-6-10-15/h7-8,11H,3-6,9-10,16H2,1-2H3.
What are the key properties of 1-(5-ethyl-2-methylphenyl)cyclohexan-1-amine?
1-(5-ethyl-2-methylphenyl)cyclohexan-1-amine has a molecular weight of 217.36 g/mol, XLogP of 3.68, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-ethyl-2-methylphenyl)cyclohexan-1-amine is sourced from PubChem (CID 117310158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).