N-[1-(2-methoxyphenyl)ethyl]-2-methylcyclopentan-1-amine

C15H23NO — CID 63278312

IUPACN-[1-(2-methoxyphenyl)ethyl]-2-methylcyclopentan-1-amine
SMILESCOc1ccccc1C(C)NC1CCCC1C
InChIInChI=1S/C15H23NO/c1-11-7-6-9-14(11)16-12(2)13-8-4-5-10-15(13)17-3/h4-5,8,10-12,14,16H,6-7,9H2,1-3H3
InChIKeyCGKLUFSRQKLFCL-UHFFFAOYSA-N
MW233.36 g/mol
LogP3.53
Rot. Bonds4

About N-[1-(2-methoxyphenyl)ethyl]-2-methylcyclopentan-1-amine

N-[1-(2-methoxyphenyl)ethyl]-2-methylcyclopentan-1-amine (PubChem CID 63278312) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is N-[1-(2-methoxyphenyl)ethyl]-2-methylcyclopentan-1-amine.

Molecular Properties

Compound NameN-[1-(2-methoxyphenyl)ethyl]-2-methylcyclopentan-1-amine
PubChem CID63278312
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC NameN-[1-(2-methoxyphenyl)ethyl]-2-methylcyclopentan-1-amine
SMILESCOc1ccccc1C(C)NC1CCCC1C
InChIInChI=1S/C15H23NO/c1-11-7-6-9-14(11)16-12(2)13-8-4-5-10-15(13)17-3/h4-5,8,10-12,14,16H,6-7,9H2,1-3H3
InChIKeyCGKLUFSRQKLFCL-UHFFFAOYSA-N
XLogP3.53
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1R)-1-(2-methoxyphenyl)ethyl]-2-methylcyclohexan-1-amine
CID 81397569
N-[(1R)-1-(2-methoxyphenyl)ethyl]-2,5-dimethylcyclohexan-1-amine
CID 81397921
2-methoxy-N-[(1S)-1-(2-methoxyphenyl)ethyl]cyclohexan-1-amine
CID 81396821
2-tert-butyl-N-[(1R)-1-(2-methoxyphenyl)ethyl]cyclohexan-1-amine
CID 81389693
2-tert-butyl-N-[1-(2-methoxyphenyl)ethyl]cyclohexan-1-amine
CID 43079642
2-[[(1R)-1-(2-methoxyphenyl)ethyl]amino]cycloheptane-1-carbonitrile
CID 81386978
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
2-methyl-N-[1-(3,4,5-trimethoxyphenyl)ethyl]cyclopentan-1-amine
CID 63278271
N-[1-(3,4-dimethoxyphenyl)ethyl]-2-methylcyclohexan-1-amine
CID 43194983
N-[1-(2-methoxyphenyl)ethyl]-1,2,5-trimethylpiperidin-4-amine
CID 43665452
2-methoxy-N-[(1S,2R)-2-methylcyclopentyl]aniline
CID 97030521

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-methoxyphenyl)ethyl]-2-methylcyclopentan-1-amine?
The IUPAC name of N-[1-(2-methoxyphenyl)ethyl]-2-methylcyclopentan-1-amine (CID 63278312) is N-[1-(2-methoxyphenyl)ethyl]-2-methylcyclopentan-1-amine.
What is the SMILES notation for N-[1-(2-methoxyphenyl)ethyl]-2-methylcyclopentan-1-amine?
The canonical SMILES for N-[1-(2-methoxyphenyl)ethyl]-2-methylcyclopentan-1-amine is COc1ccccc1C(C)NC1CCCC1C.
What is the InChIKey of N-[1-(2-methoxyphenyl)ethyl]-2-methylcyclopentan-1-amine?
The InChIKey is CGKLUFSRQKLFCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-11-7-6-9-14(11)16-12(2)13-8-4-5-10-15(13)17-3/h4-5,8,10-12,14,16H,6-7,9H2,1-3H3.
What are the key properties of N-[1-(2-methoxyphenyl)ethyl]-2-methylcyclopentan-1-amine?
N-[1-(2-methoxyphenyl)ethyl]-2-methylcyclopentan-1-amine has a molecular weight of 233.36 g/mol, XLogP of 3.53, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-methoxyphenyl)ethyl]-2-methylcyclopentan-1-amine is sourced from PubChem (CID 63278312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).