3-(phenoxymethyl)cyclopentan-1-amine

C12H17NO — CID 83618605

IUPAC3-(phenoxymethyl)cyclopentan-1-amine
SMILESNC1CCC(COc2ccccc2)C1
InChIInChI=1S/C12H17NO/c13-11-7-6-10(8-11)9-14-12-4-2-1-3-5-12/h1-5,10-11H,6-9,13H2
InChIKeyMNSIPOHSVQCSCR-UHFFFAOYSA-N
MW191.27 g/mol
LogP2.19
Rot. Bonds3

About 3-(phenoxymethyl)cyclopentan-1-amine

3-(phenoxymethyl)cyclopentan-1-amine (PubChem CID 83618605) has the molecular formula C12H17NO and a molecular weight of 191.27 g/mol. Its IUPAC name is 3-(phenoxymethyl)cyclopentan-1-amine.

Molecular Properties

Compound Name3-(phenoxymethyl)cyclopentan-1-amine
PubChem CID83618605
Molecular FormulaC12H17NO
Molecular Weight191.27 g/mol
Exact Mass191.13
IUPAC Name3-(phenoxymethyl)cyclopentan-1-amine
SMILESNC1CCC(COc2ccccc2)C1
InChIInChI=1S/C12H17NO/c13-11-7-6-10(8-11)9-14-12-4-2-1-3-5-12/h1-5,10-11H,6-9,13H2
InChIKeyMNSIPOHSVQCSCR-UHFFFAOYSA-N
XLogP2.19
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-(phenoxymethyl)cyclopentan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

cyclopropylmethoxybenzene
CID 12712156
cis-(1R,3S)-3-[(4-nitrophenoxy)methyl]cyclopentan-1-amine
CID 11962957
(1S,5R)-3-(phenoxymethyl)bicyclo[3.2.1]octane
CID 70660865
cis-(1R,3S)-3-(phenylmethoxymethyl)cyclopentan-1-amine
CID 86659751
cyclohexylmethoxybenzene
CID 14399287
(4-prop-2-enylcyclohexyl)methoxybenzene
CID 70544247
[(2S,5S)-5-(phenoxymethyl)oxan-2-yl]methanamine
CID 129389570
(3R)-3-(phenoxymethyl)pyrrolidine
CID 26192487
(4-hexylcyclohexyl)methoxybenzene
CID 57019623
[6-(phenoxymethyl)oxan-3-yl]methanamine
CID 58923660
1-ethyl-4-(phenoxymethyl)piperidine
CID 91434819
(3S)-3-(phenoxymethyl)piperidine
CID 26190643

Frequently Asked Questions

What is the IUPAC name of 3-(phenoxymethyl)cyclopentan-1-amine?
The IUPAC name of 3-(phenoxymethyl)cyclopentan-1-amine (CID 83618605) is 3-(phenoxymethyl)cyclopentan-1-amine.
What is the SMILES notation for 3-(phenoxymethyl)cyclopentan-1-amine?
The canonical SMILES for 3-(phenoxymethyl)cyclopentan-1-amine is NC1CCC(COc2ccccc2)C1.
What is the InChIKey of 3-(phenoxymethyl)cyclopentan-1-amine?
The InChIKey is MNSIPOHSVQCSCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO/c13-11-7-6-10(8-11)9-14-12-4-2-1-3-5-12/h1-5,10-11H,6-9,13H2.
What are the key properties of 3-(phenoxymethyl)cyclopentan-1-amine?
3-(phenoxymethyl)cyclopentan-1-amine has a molecular weight of 191.27 g/mol, XLogP of 2.19, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(phenoxymethyl)cyclopentan-1-amine is sourced from PubChem (CID 83618605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).