3,5-dimethyl-N-(3-methyl-2-phenylbutyl)cyclohexan-1-amine

C19H31N — CID 107876205

IUPAC3,5-dimethyl-N-(3-methyl-2-phenylbutyl)cyclohexan-1-amine
SMILESCC1CC(C)CC(NCC(c2ccccc2)C(C)C)C1
InChIInChI=1S/C19H31N/c1-14(2)19(17-8-6-5-7-9-17)13-20-18-11-15(3)10-16(4)12-18/h5-9,14-16,18-20H,10-13H2,1-4H3
InChIKeyRNAMTUAKPWPCPR-UHFFFAOYSA-N
MW273.46 g/mol
LogP4.84
Rot. Bonds5

About 3,5-dimethyl-N-(3-methyl-2-phenylbutyl)cyclohexan-1-amine

3,5-dimethyl-N-(3-methyl-2-phenylbutyl)cyclohexan-1-amine (PubChem CID 107876205) has the molecular formula C19H31N and a molecular weight of 273.46 g/mol. Its IUPAC name is 3,5-dimethyl-N-(3-methyl-2-phenylbutyl)cyclohexan-1-amine.

Molecular Properties

Compound Name3,5-dimethyl-N-(3-methyl-2-phenylbutyl)cyclohexan-1-amine
PubChem CID107876205
Molecular FormulaC19H31N
Molecular Weight273.46 g/mol
Exact Mass273.25
IUPAC Name3,5-dimethyl-N-(3-methyl-2-phenylbutyl)cyclohexan-1-amine
SMILESCC1CC(C)CC(NCC(c2ccccc2)C(C)C)C1
InChIInChI=1S/C19H31N/c1-14(2)19(17-8-6-5-7-9-17)13-20-18-11-15(3)10-16(4)12-18/h5-9,14-16,18-20H,10-13H2,1-4H3
InChIKeyRNAMTUAKPWPCPR-UHFFFAOYSA-N
XLogP4.84
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.46
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-methyl-N-(3-methyl-2-phenylbutyl)cyclohexan-1-amine
CID 107875909
N-(3-methyl-2-phenylbutyl)cyclopent-3-en-1-amine
CID 114011794
3-ethyl-N-(3-methyl-2-phenylbutyl)cyclohexan-1-amine
CID 107876207
2,2-dimethyl-N-(3-methyl-2-phenylbutyl)cyclopropan-1-amine
CID 107876110
3,3-dimethyl-N-(3-methyl-2-phenylbutyl)cyclohexan-1-amine
CID 107876320
2-[(3,5-dimethylcyclohexyl)amino]-1-(4-propan-2-ylphenyl)ethanol
CID 64733261
N-(2,2-dicyclopropylethyl)-3-methyl-2-phenylbutan-1-amine
CID 107876225
N-(2-phenylpropyl)-3-propan-2-ylcyclobutan-1-amine
CID 103560913
N-[(1S)-1-cyclopentylethyl]-3-methyl-2-phenylbutan-1-amine
CID 107876302
N-(3-methyl-2-phenylbutyl)hydroxylamine
CID 15169464
2,2-dimethyl-N-(3-methyl-2-phenylbutyl)cyclopentan-1-amine
CID 107876254
N'-(3-methylcyclopentyl)-1-phenylethane-1,2-diamine
CID 114547176

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-N-(3-methyl-2-phenylbutyl)cyclohexan-1-amine?
The IUPAC name of 3,5-dimethyl-N-(3-methyl-2-phenylbutyl)cyclohexan-1-amine (CID 107876205) is 3,5-dimethyl-N-(3-methyl-2-phenylbutyl)cyclohexan-1-amine.
What is the SMILES notation for 3,5-dimethyl-N-(3-methyl-2-phenylbutyl)cyclohexan-1-amine?
The canonical SMILES for 3,5-dimethyl-N-(3-methyl-2-phenylbutyl)cyclohexan-1-amine is CC1CC(C)CC(NCC(c2ccccc2)C(C)C)C1.
What is the InChIKey of 3,5-dimethyl-N-(3-methyl-2-phenylbutyl)cyclohexan-1-amine?
The InChIKey is RNAMTUAKPWPCPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H31N/c1-14(2)19(17-8-6-5-7-9-17)13-20-18-11-15(3)10-16(4)12-18/h5-9,14-16,18-20H,10-13H2,1-4H3.
What are the key properties of 3,5-dimethyl-N-(3-methyl-2-phenylbutyl)cyclohexan-1-amine?
3,5-dimethyl-N-(3-methyl-2-phenylbutyl)cyclohexan-1-amine has a molecular weight of 273.46 g/mol, XLogP of 4.84, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-N-(3-methyl-2-phenylbutyl)cyclohexan-1-amine is sourced from PubChem (CID 107876205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).