2,4-dimethyl-N-[(1R)-1-(4-methylphenyl)ethyl]cyclohexan-1-amine

C17H27N — CID 81349071

IUPAC2,4-dimethyl-N-[(1R)-1-(4-methylphenyl)ethyl]cyclohexan-1-amine
SMILESCc1ccc([C@@H](C)NC2CCC(C)CC2C)cc1
InChIInChI=1S/C17H27N/c1-12-5-8-16(9-6-12)15(4)18-17-10-7-13(2)11-14(17)3/h5-6,8-9,13-15,17-18H,7,10-11H2,1-4H3/t13?,14?,15-,17?/m1/s1
InChIKeyIQALGZKRWKPVMB-UKEPKTAJSA-N
MW245.41 g/mol
LogP4.47
Rot. Bonds3

About 2,4-dimethyl-N-[(1R)-1-(4-methylphenyl)ethyl]cyclohexan-1-amine

2,4-dimethyl-N-[(1R)-1-(4-methylphenyl)ethyl]cyclohexan-1-amine (PubChem CID 81349071) has the molecular formula C17H27N and a molecular weight of 245.41 g/mol. Its IUPAC name is 2,4-dimethyl-N-[(1R)-1-(4-methylphenyl)ethyl]cyclohexan-1-amine.

Molecular Properties

Compound Name2,4-dimethyl-N-[(1R)-1-(4-methylphenyl)ethyl]cyclohexan-1-amine
PubChem CID81349071
Molecular FormulaC17H27N
Molecular Weight245.41 g/mol
Exact Mass245.21
IUPAC Name2,4-dimethyl-N-[(1R)-1-(4-methylphenyl)ethyl]cyclohexan-1-amine
SMILESCc1ccc([C@@H](C)NC2CCC(C)CC2C)cc1
InChIInChI=1S/C17H27N/c1-12-5-8-16(9-6-12)15(4)18-17-10-7-13(2)11-14(17)3/h5-6,8-9,13-15,17-18H,7,10-11H2,1-4H3/t13?,14?,15-,17?/m1/s1
InChIKeyIQALGZKRWKPVMB-UKEPKTAJSA-N
XLogP4.47
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.41
LogP ≤ 54.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(1R)-1-(4-methoxyphenyl)ethyl]-2,4-dimethylcyclohexan-1-amine
CID 81370541
4-[1-[(2,4-dimethylcyclohexyl)amino]ethyl]benzonitrile
CID 63994071
2,4-dimethyl-N-[1-(4-methylphenyl)propyl]cyclohexan-1-amine
CID 63994661
2-[1-(4-methylphenyl)ethylamino]cyclobutane-1-carboxylic acid
CID 103246093
1,3-dimethyl-N-[1-(4-methylphenyl)ethyl]piperidin-4-amine
CID 115710203
2,4-dimethyl-N-[(1R)-1-(2-methylphenyl)ethyl]cyclohexan-1-amine
CID 81375454
N-[1-(3-chlorophenyl)ethyl]-2,4-dimethylcyclohexan-1-amine
CID 63994085
N-[(1S)-1-(3-methoxyphenyl)ethyl]-2,4-dimethylcyclohexan-1-amine
CID 81375875
2,4-dimethyl-N-[1-(3-propan-2-yloxyphenyl)ethyl]cyclohexan-1-amine
CID 64762616
2,6-dimethyl-N-[(1R)-1-(4-methylphenyl)ethyl]cyclohexan-1-amine
CID 81350260
N-[1-(4-methylphenyl)ethyl]cyclopropanamine
CID 16771025
N-[1-(5-bromofuran-2-yl)ethyl]-2,4-dimethylcyclohexan-1-amine
CID 113437556

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-N-[(1R)-1-(4-methylphenyl)ethyl]cyclohexan-1-amine?
The IUPAC name of 2,4-dimethyl-N-[(1R)-1-(4-methylphenyl)ethyl]cyclohexan-1-amine (CID 81349071) is 2,4-dimethyl-N-[(1R)-1-(4-methylphenyl)ethyl]cyclohexan-1-amine.
What is the SMILES notation for 2,4-dimethyl-N-[(1R)-1-(4-methylphenyl)ethyl]cyclohexan-1-amine?
The canonical SMILES for 2,4-dimethyl-N-[(1R)-1-(4-methylphenyl)ethyl]cyclohexan-1-amine is Cc1ccc([C@@H](C)NC2CCC(C)CC2C)cc1.
What is the InChIKey of 2,4-dimethyl-N-[(1R)-1-(4-methylphenyl)ethyl]cyclohexan-1-amine?
The InChIKey is IQALGZKRWKPVMB-UKEPKTAJSA-N. The full InChI is InChI=1S/C17H27N/c1-12-5-8-16(9-6-12)15(4)18-17-10-7-13(2)11-14(17)3/h5-6,8-9,13-15,17-18H,7,10-11H2,1-4H3/t13?,14?,15-,17?/m1/s1.
What are the key properties of 2,4-dimethyl-N-[(1R)-1-(4-methylphenyl)ethyl]cyclohexan-1-amine?
2,4-dimethyl-N-[(1R)-1-(4-methylphenyl)ethyl]cyclohexan-1-amine has a molecular weight of 245.41 g/mol, XLogP of 4.47, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-N-[(1R)-1-(4-methylphenyl)ethyl]cyclohexan-1-amine is sourced from PubChem (CID 81349071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).