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

C14H20FNO — CID 82812559

IUPACN-ethyl-3-(2-fluoro-3-methoxyphenyl)cyclopentan-1-amine
SMILESCCNC1CCC(c2cccc(OC)c2F)C1
InChIInChI=1S/C14H20FNO/c1-3-16-11-8-7-10(9-11)12-5-4-6-13(17-2)14(12)15/h4-6,10-11,16H,3,7-9H2,1-2H3
InChIKeyYPWWJZXMJZPOAQ-UHFFFAOYSA-N
MW237.32 g/mol
LogP3.08
Rot. Bonds4

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

N-ethyl-3-(2-fluoro-3-methoxyphenyl)cyclopentan-1-amine (PubChem CID 82812559) has the molecular formula C14H20FNO and a molecular weight of 237.32 g/mol. Its IUPAC name is N-ethyl-3-(2-fluoro-3-methoxyphenyl)cyclopentan-1-amine.

Molecular Properties

Compound NameN-ethyl-3-(2-fluoro-3-methoxyphenyl)cyclopentan-1-amine
PubChem CID82812559
Molecular FormulaC14H20FNO
Molecular Weight237.32 g/mol
Exact Mass237.15
IUPAC NameN-ethyl-3-(2-fluoro-3-methoxyphenyl)cyclopentan-1-amine
SMILESCCNC1CCC(c2cccc(OC)c2F)C1
InChIInChI=1S/C14H20FNO/c1-3-16-11-8-7-10(9-11)12-5-4-6-13(17-2)14(12)15/h4-6,10-11,16H,3,7-9H2,1-2H3
InChIKeyYPWWJZXMJZPOAQ-UHFFFAOYSA-N
XLogP3.08
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.32
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(5-chloro-2-methoxyphenyl)-N-ethylcyclopentan-1-amine
CID 64506168
N-ethyl-3-(3-fluoro-4-methoxyphenyl)cyclopentan-1-amine
CID 64504260
3-(2,6-difluorophenyl)-N-ethylcyclopentan-1-amine
CID 64504263
1-(3-bromocyclohexyl)-2-fluoro-3-methoxybenzene
CID 82812443
N-ethyl-4-methoxy-2,3-dihydro-1H-inden-1-amine
CID 61383418
N-ethyl-5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 63822452
N-ethyl-2-[(2-fluoro-3-methoxyphenyl)methyl]cyclopentan-1-amine
CID 104792652
N-ethyl-3-[3-(trifluoromethoxy)phenyl]cyclopentan-1-amine
CID 64503099
N-[(4-fluorophenyl)methyl]-3-(2-methoxyphenyl)cyclobutan-1-amine
CID 43633599
2-(2-fluoro-3-methoxyphenyl)-N-methylcyclopentan-1-amine
CID 82811854
N-ethyl-9-fluoro-8-methoxy-3-methyl-1,3,4,5-tetrahydro-2-benzothiepin-5-amine
CID 113453993
N-ethyl-3-[(2-fluoro-3-methoxyphenyl)methyl]-2-methylcyclopentan-1-amine
CID 104795135

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(2-fluoro-3-methoxyphenyl)cyclopentan-1-amine?
The IUPAC name of N-ethyl-3-(2-fluoro-3-methoxyphenyl)cyclopentan-1-amine (CID 82812559) is N-ethyl-3-(2-fluoro-3-methoxyphenyl)cyclopentan-1-amine.
What is the SMILES notation for N-ethyl-3-(2-fluoro-3-methoxyphenyl)cyclopentan-1-amine?
The canonical SMILES for N-ethyl-3-(2-fluoro-3-methoxyphenyl)cyclopentan-1-amine is CCNC1CCC(c2cccc(OC)c2F)C1.
What is the InChIKey of N-ethyl-3-(2-fluoro-3-methoxyphenyl)cyclopentan-1-amine?
The InChIKey is YPWWJZXMJZPOAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FNO/c1-3-16-11-8-7-10(9-11)12-5-4-6-13(17-2)14(12)15/h4-6,10-11,16H,3,7-9H2,1-2H3.
What are the key properties of N-ethyl-3-(2-fluoro-3-methoxyphenyl)cyclopentan-1-amine?
N-ethyl-3-(2-fluoro-3-methoxyphenyl)cyclopentan-1-amine has a molecular weight of 237.32 g/mol, XLogP of 3.08, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(2-fluoro-3-methoxyphenyl)cyclopentan-1-amine is sourced from PubChem (CID 82812559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).