[3-(cyclopentylmethoxymethyl)phenyl]methanamine

C14H21NO — CID 66324298

IUPAC[3-(cyclopentylmethoxymethyl)phenyl]methanamine
SMILESNCc1cccc(COCC2CCCC2)c1
InChIInChI=1S/C14H21NO/c15-9-13-6-3-7-14(8-13)11-16-10-12-4-1-2-5-12/h3,6-8,12H,1-2,4-5,9-11,15H2
InChIKeyBOANZGHOZWSHEA-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.85
Rot. Bonds5

About [3-(cyclopentylmethoxymethyl)phenyl]methanamine

[3-(cyclopentylmethoxymethyl)phenyl]methanamine (PubChem CID 66324298) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is [3-(cyclopentylmethoxymethyl)phenyl]methanamine.

Molecular Properties

Compound Name[3-(cyclopentylmethoxymethyl)phenyl]methanamine
PubChem CID66324298
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name[3-(cyclopentylmethoxymethyl)phenyl]methanamine
SMILESNCc1cccc(COCC2CCCC2)c1
InChIInChI=1S/C14H21NO/c15-9-13-6-3-7-14(8-13)11-16-10-12-4-1-2-5-12/h3,6-8,12H,1-2,4-5,9-11,15H2
InChIKeyBOANZGHOZWSHEA-UHFFFAOYSA-N
XLogP2.85
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[4-(cyclohexylmethoxymethyl)-2-pyridinyl]methanamine
CID 63882665
[3-chloro-4-(cyclopentylmethoxymethyl)phenyl]methanamine
CID 102663600
[4-(cyclohexylmethoxymethyl)-3-methylphenyl]methanamine
CID 114479387
[3-[(6-methylcyclohex-3-en-1-yl)methoxymethyl]phenyl]methanamine
CID 62455177
[4-(phenylmethoxymethyl)cyclohexyl]methoxymethylbenzene
CID 100982245
3-[3-(cyclohexylmethoxymethyl)phenyl]prop-2-enoic acid
CID 76942603
1-[3-(aminomethyl)phenyl]-N-(cyclopentylmethyl)methanesulfonamide
CID 54885869
[3-[(3-bromophenyl)methoxymethyl]phenyl]methanamine
CID 82827520
2-bromo-4-(cyclopentylmethoxymethyl)-1-fluorobenzene
CID 66322231
5-(phenylmethoxymethyl)cyclooctan-1-one
CID 10900938
[5-(cyclopropylmethoxymethyl)furan-3-yl]methanamine
CID 62457457
[3-(methoxymethyl)phenyl]methanamine
CID 16787292

Frequently Asked Questions

What is the IUPAC name of [3-(cyclopentylmethoxymethyl)phenyl]methanamine?
The IUPAC name of [3-(cyclopentylmethoxymethyl)phenyl]methanamine (CID 66324298) is [3-(cyclopentylmethoxymethyl)phenyl]methanamine.
What is the SMILES notation for [3-(cyclopentylmethoxymethyl)phenyl]methanamine?
The canonical SMILES for [3-(cyclopentylmethoxymethyl)phenyl]methanamine is NCc1cccc(COCC2CCCC2)c1.
What is the InChIKey of [3-(cyclopentylmethoxymethyl)phenyl]methanamine?
The InChIKey is BOANZGHOZWSHEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c15-9-13-6-3-7-14(8-13)11-16-10-12-4-1-2-5-12/h3,6-8,12H,1-2,4-5,9-11,15H2.
What are the key properties of [3-(cyclopentylmethoxymethyl)phenyl]methanamine?
[3-(cyclopentylmethoxymethyl)phenyl]methanamine has a molecular weight of 219.33 g/mol, XLogP of 2.85, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(cyclopentylmethoxymethyl)phenyl]methanamine is sourced from PubChem (CID 66324298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).