5-(2-hydroxycyclopentyl)pentanenitrile

C10H17NO — CID 10261468

IUPAC5-(2-hydroxycyclopentyl)pentanenitrile
SMILESN#CCCCCC1CCCC1O
InChIInChI=1S/C10H17NO/c11-8-3-1-2-5-9-6-4-7-10(9)12/h9-10,12H,1-7H2
InChIKeyJHVVGEANLZJMCS-UHFFFAOYSA-N
MW167.25 g/mol
LogP2.23
Rot. Bonds4

About 5-(2-hydroxycyclopentyl)pentanenitrile

5-(2-hydroxycyclopentyl)pentanenitrile (PubChem CID 10261468) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is 5-(2-hydroxycyclopentyl)pentanenitrile.

Molecular Properties

Compound Name5-(2-hydroxycyclopentyl)pentanenitrile
PubChem CID10261468
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC Name5-(2-hydroxycyclopentyl)pentanenitrile
SMILESN#CCCCCC1CCCC1O
InChIInChI=1S/C10H17NO/c11-8-3-1-2-5-9-6-4-7-10(9)12/h9-10,12H,1-7H2
InChIKeyJHVVGEANLZJMCS-UHFFFAOYSA-N
XLogP2.23
TPSA44.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-(2-hydroxycyclopentyl)pentanenitrile?
The IUPAC name of 5-(2-hydroxycyclopentyl)pentanenitrile (CID 10261468) is 5-(2-hydroxycyclopentyl)pentanenitrile.
What is the SMILES notation for 5-(2-hydroxycyclopentyl)pentanenitrile?
The canonical SMILES for 5-(2-hydroxycyclopentyl)pentanenitrile is N#CCCCCC1CCCC1O.
What is the InChIKey of 5-(2-hydroxycyclopentyl)pentanenitrile?
The InChIKey is JHVVGEANLZJMCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO/c11-8-3-1-2-5-9-6-4-7-10(9)12/h9-10,12H,1-7H2.
What are the key properties of 5-(2-hydroxycyclopentyl)pentanenitrile?
5-(2-hydroxycyclopentyl)pentanenitrile has a molecular weight of 167.25 g/mol, XLogP of 2.23, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-hydroxycyclopentyl)pentanenitrile is sourced from PubChem (CID 10261468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).