N-(3-cyano-4-cyclopentyloxyphenyl)pyridine-4-carboxamide

C18H17N3O2 — CID 141478664

IUPACN-(3-cyano-4-cyclopentyloxyphenyl)pyridine-4-carboxamide
SMILESN#Cc1cc(NC(=O)c2ccncc2)ccc1OC1CCCC1
InChIInChI=1S/C18H17N3O2/c19-12-14-11-15(21-18(22)13-7-9-20-10-8-13)5-6-17(14)23-16-3-1-2-4-16/h5-11,16H,1-4H2,(H,21,22)
InChIKeyHGIYOPSFFOCGOL-UHFFFAOYSA-N
MW307.35 g/mol
LogP3.53
Rot. Bonds4

About N-(3-cyano-4-cyclopentyloxyphenyl)pyridine-4-carboxamide

N-(3-cyano-4-cyclopentyloxyphenyl)pyridine-4-carboxamide (PubChem CID 141478664) has the molecular formula C18H17N3O2 and a molecular weight of 307.35 g/mol. Its IUPAC name is N-(3-cyano-4-cyclopentyloxyphenyl)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(3-cyano-4-cyclopentyloxyphenyl)pyridine-4-carboxamide
PubChem CID141478664
Molecular FormulaC18H17N3O2
Molecular Weight307.35 g/mol
Exact Mass307.13
IUPAC NameN-(3-cyano-4-cyclopentyloxyphenyl)pyridine-4-carboxamide
SMILESN#Cc1cc(NC(=O)c2ccncc2)ccc1OC1CCCC1
InChIInChI=1S/C18H17N3O2/c19-12-14-11-15(21-18(22)13-7-9-20-10-8-13)5-6-17(14)23-16-3-1-2-4-16/h5-11,16H,1-4H2,(H,21,22)
InChIKeyHGIYOPSFFOCGOL-UHFFFAOYSA-N
XLogP3.53
TPSA75.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-cyclopentyloxyphenyl)pyridine-4-carboxamide;hydrochloride
CID 110777040
N-(3-cyano-4-propoxyphenyl)pyridine-4-carboxamide
CID 141478692
N-(3-cyano-4-cyclopentyloxyphenyl)-2,2-difluoro-2-(1-methylimidazol-2-yl)acetamide
CID 166286793
2-chloro-N-(3-chloro-4-cyclopentyloxyphenyl)pyridine-4-carboxamide
CID 60574786
N-(3,4-dicyanophenyl)pyridazine-4-carboxamide
CID 103944391
cyclohexyl 4-(pyridine-4-carbonylamino)benzoate
CID 719338
4-cyclopentyloxy-N-(4-cyclopentyloxy-3-phenylphenyl)-3-phenylbenzamide
CID 134391732
2-cyclohexyloxy-5-nitrobenzonitrile
CID 22227856
4-amino-N-(3-cyano-4-methoxyphenyl)benzamide
CID 23791470
4-tert-butyl-N-(3,4-dicyanophenyl)benzamide
CID 78843259
N-(3-cyanophenyl)pyridine-4-carboxamide
CID 734714
N-(3-cyclopentyloxy-4-methoxyphenyl)pyridine-2-carboxamide
CID 18695632

Frequently Asked Questions

What is the IUPAC name of N-(3-cyano-4-cyclopentyloxyphenyl)pyridine-4-carboxamide?
The IUPAC name of N-(3-cyano-4-cyclopentyloxyphenyl)pyridine-4-carboxamide (CID 141478664) is N-(3-cyano-4-cyclopentyloxyphenyl)pyridine-4-carboxamide.
What is the SMILES notation for N-(3-cyano-4-cyclopentyloxyphenyl)pyridine-4-carboxamide?
The canonical SMILES for N-(3-cyano-4-cyclopentyloxyphenyl)pyridine-4-carboxamide is N#Cc1cc(NC(=O)c2ccncc2)ccc1OC1CCCC1.
What is the InChIKey of N-(3-cyano-4-cyclopentyloxyphenyl)pyridine-4-carboxamide?
The InChIKey is HGIYOPSFFOCGOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O2/c19-12-14-11-15(21-18(22)13-7-9-20-10-8-13)5-6-17(14)23-16-3-1-2-4-16/h5-11,16H,1-4H2,(H,21,22).
What are the key properties of N-(3-cyano-4-cyclopentyloxyphenyl)pyridine-4-carboxamide?
N-(3-cyano-4-cyclopentyloxyphenyl)pyridine-4-carboxamide has a molecular weight of 307.35 g/mol, XLogP of 3.53, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyano-4-cyclopentyloxyphenyl)pyridine-4-carboxamide is sourced from PubChem (CID 141478664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).