3-phenylmethoxycyclopentan-1-amine

C12H17NO — CID 79421215

IUPAC3-phenylmethoxycyclopentan-1-amine
SMILESNC1CCC(OCc2ccccc2)C1
InChIInChI=1S/C12H17NO/c13-11-6-7-12(8-11)14-9-10-4-2-1-3-5-10/h1-5,11-12H,6-9,13H2
InChIKeyLIZCJJIXNPWSPE-UHFFFAOYSA-N
MW191.27 g/mol
LogP2.08
Rot. Bonds3

About 3-phenylmethoxycyclopentan-1-amine

3-phenylmethoxycyclopentan-1-amine (PubChem CID 79421215) has the molecular formula C12H17NO and a molecular weight of 191.27 g/mol. Its IUPAC name is 3-phenylmethoxycyclopentan-1-amine.

Molecular Properties

Compound Name3-phenylmethoxycyclopentan-1-amine
PubChem CID79421215
Molecular FormulaC12H17NO
Molecular Weight191.27 g/mol
Exact Mass191.13
IUPAC Name3-phenylmethoxycyclopentan-1-amine
SMILESNC1CCC(OCc2ccccc2)C1
InChIInChI=1S/C12H17NO/c13-11-6-7-12(8-11)14-9-10-4-2-1-3-5-10/h1-5,11-12H,6-9,13H2
InChIKeyLIZCJJIXNPWSPE-UHFFFAOYSA-N
XLogP2.08
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 ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(4-chlorophenyl)methoxy]cyclopentan-1-amine
CID 79458134
(1R,2R,5S)-2-chloro-5-phenylmethoxycyclohexan-1-amine
CID 10354246
(1R,2R,5S)-5-phenylmethoxy-2-phenylsulfanylcyclohexan-1-amine
CID 10448310
6,15,24,33-tetrakis(phenylmethoxy)-2,11,20,29,37,38,39,40-octazanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetracontane
CID 173466945
cis-(1R,3S)-3-(phenylmethoxymethyl)cyclopentan-1-amine
CID 86659751
3-[(4-chlorophenyl)methoxy]cyclohexan-1-amine
CID 79466104
(3-phenylmethoxycyclopentanecarbonyl) 3-phenylmethoxycyclopentane-1-carboxylate
CID 141325822
azane;cyclopentyloxymethylbenzene
CID 69411306
(4-phenylcyclohexyl)oxymethylbenzene
CID 11043723
(4-propylcyclohexyl)oxymethylbenzene
CID 147199890
trans-(1R,3R)-3-phenylmethoxycyclohexan-1-ol
CID 14172790
3-(quinolin-2-ylmethoxy)cyclopentan-1-amine
CID 79465376

Frequently Asked Questions

What is the IUPAC name of 3-phenylmethoxycyclopentan-1-amine?
The IUPAC name of 3-phenylmethoxycyclopentan-1-amine (CID 79421215) is 3-phenylmethoxycyclopentan-1-amine.
What is the SMILES notation for 3-phenylmethoxycyclopentan-1-amine?
The canonical SMILES for 3-phenylmethoxycyclopentan-1-amine is NC1CCC(OCc2ccccc2)C1.
What is the InChIKey of 3-phenylmethoxycyclopentan-1-amine?
The InChIKey is LIZCJJIXNPWSPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO/c13-11-6-7-12(8-11)14-9-10-4-2-1-3-5-10/h1-5,11-12H,6-9,13H2.
What are the key properties of 3-phenylmethoxycyclopentan-1-amine?
3-phenylmethoxycyclopentan-1-amine has a molecular weight of 191.27 g/mol, XLogP of 2.08, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenylmethoxycyclopentan-1-amine is sourced from PubChem (CID 79421215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).