N-ethyl-5-methyl-2-[2-(4-methylphenyl)propan-2-yl]cyclohexan-1-amine

C19H31N — CID 64767391

IUPACN-ethyl-5-methyl-2-[2-(4-methylphenyl)propan-2-yl]cyclohexan-1-amine
SMILESCCNC1CC(C)CCC1C(C)(C)c1ccc(C)cc1
InChIInChI=1S/C19H31N/c1-6-20-18-13-15(3)9-12-17(18)19(4,5)16-10-7-14(2)8-11-16/h7-8,10-11,15,17-18,20H,6,9,12-13H2,1-5H3
InChIKeyARBVDVRYAUDKOD-UHFFFAOYSA-N
MW273.46 g/mol
LogP4.69
Rot. Bonds4

About N-ethyl-5-methyl-2-[2-(4-methylphenyl)propan-2-yl]cyclohexan-1-amine

N-ethyl-5-methyl-2-[2-(4-methylphenyl)propan-2-yl]cyclohexan-1-amine (PubChem CID 64767391) has the molecular formula C19H31N and a molecular weight of 273.46 g/mol. Its IUPAC name is N-ethyl-5-methyl-2-[2-(4-methylphenyl)propan-2-yl]cyclohexan-1-amine.

Molecular Properties

Compound NameN-ethyl-5-methyl-2-[2-(4-methylphenyl)propan-2-yl]cyclohexan-1-amine
PubChem CID64767391
Molecular FormulaC19H31N
Molecular Weight273.46 g/mol
Exact Mass273.25
IUPAC NameN-ethyl-5-methyl-2-[2-(4-methylphenyl)propan-2-yl]cyclohexan-1-amine
SMILESCCNC1CC(C)CCC1C(C)(C)c1ccc(C)cc1
InChIInChI=1S/C19H31N/c1-6-20-18-13-15(3)9-12-17(18)19(4,5)16-10-7-14(2)8-11-16/h7-8,10-11,15,17-18,20H,6,9,12-13H2,1-5H3
InChIKeyARBVDVRYAUDKOD-UHFFFAOYSA-N
XLogP4.69
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.46
LogP ≤ 54.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-methyl-2-[2-(3-methylphenyl)propan-2-yl]-N-propylcyclohexan-1-amine
CID 64766425
3-[2-[2-(ethylamino)-4-methylcyclohexyl]propan-2-yl]-5-methylpyridin-2-amine
CID 64766235
3-[2-[2-(ethylamino)-4-methylcyclohexyl]propan-2-yl]pyridin-2-amine
CID 64767305
5-methyl-N-propyl-2-(2-thiophen-3-ylpropan-2-yl)cyclohexan-1-amine
CID 65102404
5-methyl-2-[2-(4-methyl-3-pyridinyl)propan-2-yl]-N-propylcyclohexan-1-amine
CID 66272759
2-[1-(2-chlorophenyl)-2-methylpropan-2-yl]-N-ethyl-5-methylcyclohexan-1-amine
CID 64766686
1-[2-(2-chloro-4-methylcyclohexyl)propan-2-yl]-4-propylbenzene
CID 64766355
2-[2-(3-fluoro-5-methylphenyl)propan-2-yl]-N,5-dimethylcyclohexan-1-amine
CID 79705337
N-ethyl-5-methyl-2-[2-(oxolan-3-yl)propan-2-yl]cyclohexan-1-amine
CID 64766683
2-[2-(furan-3-yl)propan-2-yl]-N,5-dimethylcyclohexan-1-amine
CID 64764252
N-ethyl-5-methyl-2-[2-methyl-1-(1-methylpyrazol-4-yl)propan-2-yl]cyclohexan-1-amine
CID 64767394
N-ethyl-4-methyl-2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)cyclohexan-1-amine
CID 63466781

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-methyl-2-[2-(4-methylphenyl)propan-2-yl]cyclohexan-1-amine?
The IUPAC name of N-ethyl-5-methyl-2-[2-(4-methylphenyl)propan-2-yl]cyclohexan-1-amine (CID 64767391) is N-ethyl-5-methyl-2-[2-(4-methylphenyl)propan-2-yl]cyclohexan-1-amine.
What is the SMILES notation for N-ethyl-5-methyl-2-[2-(4-methylphenyl)propan-2-yl]cyclohexan-1-amine?
The canonical SMILES for N-ethyl-5-methyl-2-[2-(4-methylphenyl)propan-2-yl]cyclohexan-1-amine is CCNC1CC(C)CCC1C(C)(C)c1ccc(C)cc1.
What is the InChIKey of N-ethyl-5-methyl-2-[2-(4-methylphenyl)propan-2-yl]cyclohexan-1-amine?
The InChIKey is ARBVDVRYAUDKOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H31N/c1-6-20-18-13-15(3)9-12-17(18)19(4,5)16-10-7-14(2)8-11-16/h7-8,10-11,15,17-18,20H,6,9,12-13H2,1-5H3.
What are the key properties of N-ethyl-5-methyl-2-[2-(4-methylphenyl)propan-2-yl]cyclohexan-1-amine?
N-ethyl-5-methyl-2-[2-(4-methylphenyl)propan-2-yl]cyclohexan-1-amine has a molecular weight of 273.46 g/mol, XLogP of 4.69, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-methyl-2-[2-(4-methylphenyl)propan-2-yl]cyclohexan-1-amine is sourced from PubChem (CID 64767391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).