N-[(2-methylcyclopentyl)methyl]-1-phenylethanamine

C15H23N — CID 107417351

IUPACN-[(2-methylcyclopentyl)methyl]-1-phenylethanamine
SMILESCC(NCC1CCCC1C)c1ccccc1
InChIInChI=1S/C15H23N/c1-12-7-6-10-15(12)11-16-13(2)14-8-4-3-5-9-14/h3-5,8-9,12-13,15-16H,6-7,10-11H2,1-2H3
InChIKeyWDEKDMQLQGZHCN-UHFFFAOYSA-N
MW217.36 g/mol
LogP3.77
Rot. Bonds4

About N-[(2-methylcyclopentyl)methyl]-1-phenylethanamine

N-[(2-methylcyclopentyl)methyl]-1-phenylethanamine (PubChem CID 107417351) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is N-[(2-methylcyclopentyl)methyl]-1-phenylethanamine.

Molecular Properties

Compound NameN-[(2-methylcyclopentyl)methyl]-1-phenylethanamine
PubChem CID107417351
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC NameN-[(2-methylcyclopentyl)methyl]-1-phenylethanamine
SMILESCC(NCC1CCCC1C)c1ccccc1
InChIInChI=1S/C15H23N/c1-12-7-6-10-15(12)11-16-13(2)14-8-4-3-5-9-14/h3-5,8-9,12-13,15-16H,6-7,10-11H2,1-2H3
InChIKeyWDEKDMQLQGZHCN-UHFFFAOYSA-N
XLogP3.77
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(2-methylcyclohexyl)methyl]-1-[4-(2-methylpropyl)phenyl]ethanamine
CID 63455907
3-methyl-N-[(2-methylcyclohexyl)methyl]-1-phenylbutan-1-amine
CID 63453789
1-(3,4-dimethylphenyl)-N-[(2-methylcyclopentyl)methyl]ethanamine
CID 107417364
1-(1-benzofuran-2-yl)-N-[(2-methylcyclopentyl)methyl]ethanamine
CID 107417019
1-(2-ethoxyphenyl)-N-[(2-methylcyclopentyl)methyl]ethanamine
CID 107416791
4-methyl-N-[(2-methylcyclopentyl)methyl]-4-phenylpentan-2-amine
CID 107417617
N-[(2-methylcyclopentyl)methyl]-2,2-diphenylacetamide
CID 167190715
N-[(2-methylcyclopentyl)methyl]-1-(2,4,6-trimethylphenyl)ethanamine
CID 107417014
trans-(1S,2S)-2-methyl-N-[(1S)-1-phenylethyl]cyclopentan-1-amine
CID 95377360
cis-(1R,2S)-2-methyl-N-[(1S)-1-phenylethyl]cyclopentan-1-amine
CID 95377362
N-(2-cyclobutylethyl)-1-phenylethanamine
CID 115688569
5-fluoro-2-[1-[(2-methylcyclopentyl)methylamino]ethyl]phenol
CID 107417292

Frequently Asked Questions

What is the IUPAC name of N-[(2-methylcyclopentyl)methyl]-1-phenylethanamine?
The IUPAC name of N-[(2-methylcyclopentyl)methyl]-1-phenylethanamine (CID 107417351) is N-[(2-methylcyclopentyl)methyl]-1-phenylethanamine.
What is the SMILES notation for N-[(2-methylcyclopentyl)methyl]-1-phenylethanamine?
The canonical SMILES for N-[(2-methylcyclopentyl)methyl]-1-phenylethanamine is CC(NCC1CCCC1C)c1ccccc1.
What is the InChIKey of N-[(2-methylcyclopentyl)methyl]-1-phenylethanamine?
The InChIKey is WDEKDMQLQGZHCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c1-12-7-6-10-15(12)11-16-13(2)14-8-4-3-5-9-14/h3-5,8-9,12-13,15-16H,6-7,10-11H2,1-2H3.
What are the key properties of N-[(2-methylcyclopentyl)methyl]-1-phenylethanamine?
N-[(2-methylcyclopentyl)methyl]-1-phenylethanamine has a molecular weight of 217.36 g/mol, XLogP of 3.77, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methylcyclopentyl)methyl]-1-phenylethanamine is sourced from PubChem (CID 107417351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).