3-ethyl-N-[(2-methoxyphenyl)methyl]cyclopentan-1-amine

C15H23NO — CID 64500368

IUPAC3-ethyl-N-[(2-methoxyphenyl)methyl]cyclopentan-1-amine
SMILESCCC1CCC(NCc2ccccc2OC)C1
InChIInChI=1S/C15H23NO/c1-3-12-8-9-14(10-12)16-11-13-6-4-5-7-15(13)17-2/h4-7,12,14,16H,3,8-11H2,1-2H3
InChIKeyJJJZWXYUXLQPMY-UHFFFAOYSA-N
MW233.35 g/mol
LogP3.36
Rot. Bonds5

About 3-ethyl-N-[(2-methoxyphenyl)methyl]cyclopentan-1-amine

3-ethyl-N-[(2-methoxyphenyl)methyl]cyclopentan-1-amine (PubChem CID 64500368) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is 3-ethyl-N-[(2-methoxyphenyl)methyl]cyclopentan-1-amine.

Molecular Properties

Compound Name3-ethyl-N-[(2-methoxyphenyl)methyl]cyclopentan-1-amine
PubChem CID64500368
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC Name3-ethyl-N-[(2-methoxyphenyl)methyl]cyclopentan-1-amine
SMILESCCC1CCC(NCc2ccccc2OC)C1
InChIInChI=1S/C15H23NO/c1-3-12-8-9-14(10-12)16-11-13-6-4-5-7-15(13)17-2/h4-7,12,14,16H,3,8-11H2,1-2H3
InChIKeyJJJZWXYUXLQPMY-UHFFFAOYSA-N
XLogP3.36
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2,4-dimethoxyphenyl)methyl]-3-ethylcyclopentan-1-amine
CID 64500923
2-[[(3-ethylcyclohexyl)amino]methyl]-6-methoxyphenol
CID 64742005
N-[(2-methoxyphenyl)methyl]cyclooctanamine;hydrochloride
CID 17331524
3-N-[2-(2-methoxyphenyl)ethyl]cyclopentane-1,3-diamine
CID 114165383
3-ethyl-N-[(1R)-1-(2-methoxyphenyl)ethyl]cyclopentan-1-amine
CID 81397757
trans-(1R,2R)-1-N,2-N-bis[(2-methoxyphenyl)methyl]cyclohexane-1,2-diamine
CID 71414214
methyl 2-[[(3-ethylcyclohexyl)amino]methyl]benzoate
CID 64741423
1-[[2-[[(3-ethylcyclopentyl)amino]methyl]phenyl]methyl]piperidin-4-ol
CID 111778147
tert-butyl N-[3-[(2-methoxyphenyl)methylamino]cyclopentyl]carbamate
CID 103719601
trans-(1S,2R)-2-ethyl-N-[(2-methoxyphenyl)methyl]cyclohexan-1-amine
CID 93046208
2-[(2-methoxyphenyl)methylamino]cyclopentan-1-ol
CID 60713485
1-[(2-bromo-5-ethylcyclohexyl)methyl]-2-methoxybenzene
CID 63473365

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-[(2-methoxyphenyl)methyl]cyclopentan-1-amine?
The IUPAC name of 3-ethyl-N-[(2-methoxyphenyl)methyl]cyclopentan-1-amine (CID 64500368) is 3-ethyl-N-[(2-methoxyphenyl)methyl]cyclopentan-1-amine.
What is the SMILES notation for 3-ethyl-N-[(2-methoxyphenyl)methyl]cyclopentan-1-amine?
The canonical SMILES for 3-ethyl-N-[(2-methoxyphenyl)methyl]cyclopentan-1-amine is CCC1CCC(NCc2ccccc2OC)C1.
What is the InChIKey of 3-ethyl-N-[(2-methoxyphenyl)methyl]cyclopentan-1-amine?
The InChIKey is JJJZWXYUXLQPMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-3-12-8-9-14(10-12)16-11-13-6-4-5-7-15(13)17-2/h4-7,12,14,16H,3,8-11H2,1-2H3.
What are the key properties of 3-ethyl-N-[(2-methoxyphenyl)methyl]cyclopentan-1-amine?
3-ethyl-N-[(2-methoxyphenyl)methyl]cyclopentan-1-amine has a molecular weight of 233.35 g/mol, XLogP of 3.36, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-[(2-methoxyphenyl)methyl]cyclopentan-1-amine is sourced from PubChem (CID 64500368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).