[1-(3-phenylmethoxyphenyl)cyclopentyl]methanamine

C19H23NO — CID 117451817

IUPAC[1-(3-phenylmethoxyphenyl)cyclopentyl]methanamine
SMILESNCC1(c2cccc(OCc3ccccc3)c2)CCCC1
InChIInChI=1S/C19H23NO/c20-15-19(11-4-5-12-19)17-9-6-10-18(13-17)21-14-16-7-2-1-3-8-16/h1-3,6-10,13H,4-5,11-12,14-15,20H2
InChIKeyBAINGRYZDSZIME-UHFFFAOYSA-N
MW281.40 g/mol
LogP4.04
Rot. Bonds5

About [1-(3-phenylmethoxyphenyl)cyclopentyl]methanamine

[1-(3-phenylmethoxyphenyl)cyclopentyl]methanamine (PubChem CID 117451817) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is [1-(3-phenylmethoxyphenyl)cyclopentyl]methanamine.

Molecular Properties

Compound Name[1-(3-phenylmethoxyphenyl)cyclopentyl]methanamine
PubChem CID117451817
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC Name[1-(3-phenylmethoxyphenyl)cyclopentyl]methanamine
SMILESNCC1(c2cccc(OCc3ccccc3)c2)CCCC1
InChIInChI=1S/C19H23NO/c20-15-19(11-4-5-12-19)17-9-6-10-18(13-17)21-14-16-7-2-1-3-8-16/h1-3,6-10,13H,4-5,11-12,14-15,20H2
InChIKeyBAINGRYZDSZIME-UHFFFAOYSA-N
XLogP4.04
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[1-(3-fluoro-4-phenylmethoxyphenyl)cyclohexyl]methanamine
CID 117498798
4-[3-[1-(aminomethyl)cyclobutyl]phenoxy]aniline
CID 116996678
2-[1-(aminomethyl)cyclohexyl]-6-phenylmethoxyphenol
CID 117496323
[1-[3-(1-methylazetidin-3-yl)oxyphenyl]cyclopentyl]methanamine
CID 117405631
[1-[3-(1-methylazetidin-3-yl)oxyphenyl]cyclohexyl]methanamine
CID 117438827
2-(aminomethyl)-4-phenylmethoxyaniline
CID 156839624
4-[3-[1-(aminomethyl)cyclopropyl]phenoxy]aniline
CID 116996675
1-[3-[1-(aminomethyl)cyclohexyl]phenyl]-2-methylpropan-2-ol
CID 117113390
N-methyl-1-[3-(3-phenylmethoxyphenyl)phenyl]cyclopropan-1-amine;hydrochloride
CID 172875844
[4-(3-methoxyphenyl)oxan-4-yl]methanamine
CID 61264029
[1-[3-[1-(aminomethyl)cyclopropyl]phenyl]cyclopropyl]methanol
CID 117112180
1-(chloromethyl)-3-phenylmethoxybenzene
CID 13173490

Frequently Asked Questions

What is the IUPAC name of [1-(3-phenylmethoxyphenyl)cyclopentyl]methanamine?
The IUPAC name of [1-(3-phenylmethoxyphenyl)cyclopentyl]methanamine (CID 117451817) is [1-(3-phenylmethoxyphenyl)cyclopentyl]methanamine.
What is the SMILES notation for [1-(3-phenylmethoxyphenyl)cyclopentyl]methanamine?
The canonical SMILES for [1-(3-phenylmethoxyphenyl)cyclopentyl]methanamine is NCC1(c2cccc(OCc3ccccc3)c2)CCCC1.
What is the InChIKey of [1-(3-phenylmethoxyphenyl)cyclopentyl]methanamine?
The InChIKey is BAINGRYZDSZIME-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c20-15-19(11-4-5-12-19)17-9-6-10-18(13-17)21-14-16-7-2-1-3-8-16/h1-3,6-10,13H,4-5,11-12,14-15,20H2.
What are the key properties of [1-(3-phenylmethoxyphenyl)cyclopentyl]methanamine?
[1-(3-phenylmethoxyphenyl)cyclopentyl]methanamine has a molecular weight of 281.40 g/mol, XLogP of 4.04, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-phenylmethoxyphenyl)cyclopentyl]methanamine is sourced from PubChem (CID 117451817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).