N-ethyl-2-(3-methoxyphenyl)cyclopentan-1-amine

C14H21NO — CID 62604232

IUPACN-ethyl-2-(3-methoxyphenyl)cyclopentan-1-amine
SMILESCCNC1CCCC1c1cccc(OC)c1
InChIInChI=1S/C14H21NO/c1-3-15-14-9-5-8-13(14)11-6-4-7-12(10-11)16-2/h4,6-7,10,13-15H,3,5,8-9H2,1-2H3
InChIKeyMESDYJAPLBIYJR-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.94
Rot. Bonds4

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

N-ethyl-2-(3-methoxyphenyl)cyclopentan-1-amine (PubChem CID 62604232) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is N-ethyl-2-(3-methoxyphenyl)cyclopentan-1-amine.

Molecular Properties

Compound NameN-ethyl-2-(3-methoxyphenyl)cyclopentan-1-amine
PubChem CID62604232
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC NameN-ethyl-2-(3-methoxyphenyl)cyclopentan-1-amine
SMILESCCNC1CCCC1c1cccc(OC)c1
InChIInChI=1S/C14H21NO/c1-3-15-14-9-5-8-13(14)11-6-4-7-12(10-11)16-2/h4,6-7,10,13-15H,3,5,8-9H2,1-2H3
InChIKeyMESDYJAPLBIYJR-UHFFFAOYSA-N
XLogP2.94
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-methoxyphenyl)-N-methylcyclohexan-1-amine
CID 62603851
[2-(3-methoxyphenyl)cyclohexyl]hydrazine
CID 53402469
2-(3-methoxyphenyl)-N-(2-phenylethyl)cyclohexan-1-amine
CID 21260489
N-ethyl-2-(3-methylphenyl)cycloheptan-1-amine
CID 62604421
2-(3-methoxyphenyl)cyclopentan-1-amine
CID 62605139
2-(3,4-diethoxyphenyl)-N-ethylcyclopentan-1-amine
CID 62802621
N-ethyl-2-[3-(2-methylpropyl)phenyl]cycloheptan-1-amine
CID 116545575
N-propyl-2-[3-(trifluoromethoxy)phenyl]cyclohexan-1-amine
CID 63511320
[2-(3-methoxyphenyl)cyclohexyl]methanamine
CID 10443420
[(1R,2R)-2-(3-methoxyphenyl)cyclohexyl]methanamine;N-methylmethanamine
CID 69422945
1-[2-(3-methoxyphenyl)cycloheptyl]-N-methylmethanamine
CID 81026200
N-ethyl-2-(4-methylphenyl)cyclopentan-1-amine
CID 62604410

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(3-methoxyphenyl)cyclopentan-1-amine?
The IUPAC name of N-ethyl-2-(3-methoxyphenyl)cyclopentan-1-amine (CID 62604232) is N-ethyl-2-(3-methoxyphenyl)cyclopentan-1-amine.
What is the SMILES notation for N-ethyl-2-(3-methoxyphenyl)cyclopentan-1-amine?
The canonical SMILES for N-ethyl-2-(3-methoxyphenyl)cyclopentan-1-amine is CCNC1CCCC1c1cccc(OC)c1.
What is the InChIKey of N-ethyl-2-(3-methoxyphenyl)cyclopentan-1-amine?
The InChIKey is MESDYJAPLBIYJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-3-15-14-9-5-8-13(14)11-6-4-7-12(10-11)16-2/h4,6-7,10,13-15H,3,5,8-9H2,1-2H3.
What are the key properties of N-ethyl-2-(3-methoxyphenyl)cyclopentan-1-amine?
N-ethyl-2-(3-methoxyphenyl)cyclopentan-1-amine has a molecular weight of 219.33 g/mol, XLogP of 2.94, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(3-methoxyphenyl)cyclopentan-1-amine is sourced from PubChem (CID 62604232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).