N-[2-cyclohexyl-2-(2-methylphenyl)ethyl]propan-2-amine

C18H29N — CID 82932644

IUPACN-[2-cyclohexyl-2-(2-methylphenyl)ethyl]propan-2-amine
SMILESCc1ccccc1C(CNC(C)C)C1CCCCC1
InChIInChI=1S/C18H29N/c1-14(2)19-13-18(16-10-5-4-6-11-16)17-12-8-7-9-15(17)3/h7-9,12,14,16,18-19H,4-6,10-11,13H2,1-3H3
InChIKeyRSQFSAATTYNNRR-UHFFFAOYSA-N
MW259.44 g/mol
LogP4.66
Rot. Bonds5

About N-[2-cyclohexyl-2-(2-methylphenyl)ethyl]propan-2-amine

N-[2-cyclohexyl-2-(2-methylphenyl)ethyl]propan-2-amine (PubChem CID 82932644) has the molecular formula C18H29N and a molecular weight of 259.44 g/mol. Its IUPAC name is N-[2-cyclohexyl-2-(2-methylphenyl)ethyl]propan-2-amine.

Molecular Properties

Compound NameN-[2-cyclohexyl-2-(2-methylphenyl)ethyl]propan-2-amine
PubChem CID82932644
Molecular FormulaC18H29N
Molecular Weight259.44 g/mol
Exact Mass259.23
IUPAC NameN-[2-cyclohexyl-2-(2-methylphenyl)ethyl]propan-2-amine
SMILESCc1ccccc1C(CNC(C)C)C1CCCCC1
InChIInChI=1S/C18H29N/c1-14(2)19-13-18(16-10-5-4-6-11-16)17-12-8-7-9-15(17)3/h7-9,12,14,16,18-19H,4-6,10-11,13H2,1-3H3
InChIKeyRSQFSAATTYNNRR-UHFFFAOYSA-N
XLogP4.66
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.44
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[2-cycloheptyl-2-(2-fluorophenyl)ethyl]propan-2-amine
CID 82933173
N-[2-cyclohexyl-2-(2-methylphenyl)ethyl]propan-1-amine
CID 82933275
1,5-dicyclopentyl-1,5-bis(2-methylphenyl)pentan-3-one
CID 73011663
(1S)-1-cycloheptyl-N-[1-(2-methylphenyl)ethyl]ethanamine
CID 81390722
3-cyclopentyl-3-(2-methylphenyl)propanamide
CID 82082222
1,5-di(cyclobutyl)-1,5-bis(2-methylphenyl)pentan-3-one
CID 73011538
[cyclooctyl-(2-methylphenyl)methyl]hydrazine
CID 105254975
2-cyclohexyl-2-(2-methylphenyl)acetonitrile
CID 79019577
N-[2-cyclohexyl-2-(3-methoxy-4-methylphenyl)ethyl]propan-2-amine
CID 82924013
N-[2-(2-bromophenyl)-2-cyclohexylethyl]-2-methylpropan-1-amine
CID 82936298
N-[2-(2-bromophenyl)-2-cyclohexylethyl]-2-methylpropan-2-amine
CID 82933829
N-[2-(4-chlorophenyl)-2-cyclopentylethyl]propan-2-amine
CID 82933059

Frequently Asked Questions

What is the IUPAC name of N-[2-cyclohexyl-2-(2-methylphenyl)ethyl]propan-2-amine?
The IUPAC name of N-[2-cyclohexyl-2-(2-methylphenyl)ethyl]propan-2-amine (CID 82932644) is N-[2-cyclohexyl-2-(2-methylphenyl)ethyl]propan-2-amine.
What is the SMILES notation for N-[2-cyclohexyl-2-(2-methylphenyl)ethyl]propan-2-amine?
The canonical SMILES for N-[2-cyclohexyl-2-(2-methylphenyl)ethyl]propan-2-amine is Cc1ccccc1C(CNC(C)C)C1CCCCC1.
What is the InChIKey of N-[2-cyclohexyl-2-(2-methylphenyl)ethyl]propan-2-amine?
The InChIKey is RSQFSAATTYNNRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N/c1-14(2)19-13-18(16-10-5-4-6-11-16)17-12-8-7-9-15(17)3/h7-9,12,14,16,18-19H,4-6,10-11,13H2,1-3H3.
What are the key properties of N-[2-cyclohexyl-2-(2-methylphenyl)ethyl]propan-2-amine?
N-[2-cyclohexyl-2-(2-methylphenyl)ethyl]propan-2-amine has a molecular weight of 259.44 g/mol, XLogP of 4.66, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-cyclohexyl-2-(2-methylphenyl)ethyl]propan-2-amine is sourced from PubChem (CID 82932644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).