3-[(4-chlorophenyl)methoxy]cyclopentan-1-amine

C12H16ClNO — CID 79458134

IUPAC3-[(4-chlorophenyl)methoxy]cyclopentan-1-amine
SMILESNC1CCC(OCc2ccc(Cl)cc2)C1
InChIInChI=1S/C12H16ClNO/c13-10-3-1-9(2-4-10)8-15-12-6-5-11(14)7-12/h1-4,11-12H,5-8,14H2
InChIKeyQXDAMRIYUMJMRN-UHFFFAOYSA-N
MW225.72 g/mol
LogP2.74
Rot. Bonds3

About 3-[(4-chlorophenyl)methoxy]cyclopentan-1-amine

3-[(4-chlorophenyl)methoxy]cyclopentan-1-amine (PubChem CID 79458134) has the molecular formula C12H16ClNO and a molecular weight of 225.72 g/mol. Its IUPAC name is 3-[(4-chlorophenyl)methoxy]cyclopentan-1-amine.

Molecular Properties

Compound Name3-[(4-chlorophenyl)methoxy]cyclopentan-1-amine
PubChem CID79458134
Molecular FormulaC12H16ClNO
Molecular Weight225.72 g/mol
Exact Mass225.09
IUPAC Name3-[(4-chlorophenyl)methoxy]cyclopentan-1-amine
SMILESNC1CCC(OCc2ccc(Cl)cc2)C1
InChIInChI=1S/C12H16ClNO/c13-10-3-1-9(2-4-10)8-15-12-6-5-11(14)7-12/h1-4,11-12H,5-8,14H2
InChIKeyQXDAMRIYUMJMRN-UHFFFAOYSA-N
XLogP2.74
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.72
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(4-chlorophenyl)methoxy]cyclohexan-1-amine
CID 79466104
3-phenylmethoxycyclopentan-1-amine
CID 79421215
3-[(3-chloro-4-pyridinyl)methoxy]cyclopentan-1-amine
CID 79465484
4-[(4-chlorophenyl)methoxy]piperidine
CID 13194424
(1R,2R,5S)-2-chloro-5-phenylmethoxycyclohexan-1-amine
CID 10354246
3-[(4-chlorophenyl)methoxy]-1-methylpiperidine
CID 59165688
1-chloro-2-[(1S,3S)-3-[(4-chlorophenyl)methoxy]cyclopentyl]sulfonylbenzene
CID 90106767
1-[[4-(4-but-3-enylcyclohexyl)cyclohexyl]oxymethyl]-4-chlorobenzene
CID 19380443
ethyl 3-[[3-[(4-chlorophenyl)methoxy]cyclobutyl]methylamino]propanoate
CID 118176764
3-[(3-bromothiophen-2-yl)methoxy]cyclopentan-1-amine
CID 79464740
3-[(4-chlorophenyl)methylsulfonyl]cyclopentan-1-amine
CID 114792054
3-[(4-chloro-2-nitrophenyl)methoxy]cyclohexan-1-amine
CID 79464860

Frequently Asked Questions

What is the IUPAC name of 3-[(4-chlorophenyl)methoxy]cyclopentan-1-amine?
The IUPAC name of 3-[(4-chlorophenyl)methoxy]cyclopentan-1-amine (CID 79458134) is 3-[(4-chlorophenyl)methoxy]cyclopentan-1-amine.
What is the SMILES notation for 3-[(4-chlorophenyl)methoxy]cyclopentan-1-amine?
The canonical SMILES for 3-[(4-chlorophenyl)methoxy]cyclopentan-1-amine is NC1CCC(OCc2ccc(Cl)cc2)C1.
What is the InChIKey of 3-[(4-chlorophenyl)methoxy]cyclopentan-1-amine?
The InChIKey is QXDAMRIYUMJMRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16ClNO/c13-10-3-1-9(2-4-10)8-15-12-6-5-11(14)7-12/h1-4,11-12H,5-8,14H2.
What are the key properties of 3-[(4-chlorophenyl)methoxy]cyclopentan-1-amine?
3-[(4-chlorophenyl)methoxy]cyclopentan-1-amine has a molecular weight of 225.72 g/mol, XLogP of 2.74, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-chlorophenyl)methoxy]cyclopentan-1-amine is sourced from PubChem (CID 79458134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).