N-(1-cyanocyclopropyl)pyridine-2-carboxamide

C10H9N3O — CID 160579083

IUPACN-(1-cyanocyclopropyl)pyridine-2-carboxamide
SMILESN#CC1(NC(=O)c2ccccn2)CC1
InChIInChI=1S/C10H9N3O/c11-7-10(4-5-10)13-9(14)8-3-1-2-6-12-8/h1-3,6H,4-5H2,(H,13,14)
InChIKeyRBNNQLREVGECSB-UHFFFAOYSA-N
MW187.20 g/mol
LogP0.87
Rot. Bonds2

About N-(1-cyanocyclopropyl)pyridine-2-carboxamide

N-(1-cyanocyclopropyl)pyridine-2-carboxamide (PubChem CID 160579083) has the molecular formula C10H9N3O and a molecular weight of 187.20 g/mol. Its IUPAC name is N-(1-cyanocyclopropyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(1-cyanocyclopropyl)pyridine-2-carboxamide
PubChem CID160579083
Molecular FormulaC10H9N3O
Molecular Weight187.20 g/mol
Exact Mass187.07
IUPAC NameN-(1-cyanocyclopropyl)pyridine-2-carboxamide
SMILESN#CC1(NC(=O)c2ccccn2)CC1
InChIInChI=1S/C10H9N3O/c11-7-10(4-5-10)13-9(14)8-3-1-2-6-12-8/h1-3,6H,4-5H2,(H,13,14)
InChIKeyRBNNQLREVGECSB-UHFFFAOYSA-N
XLogP0.87
TPSA65.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.20
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-N-(1-cyanocyclohexyl)pyridine-2-carboxamide
CID 78831230
N-(1-methylcyclobutyl)pyridine-2-carboxamide
CID 175814951
N-(1-cyanocyclopentyl)-6-methylpyridine-2-carboxamide
CID 60727656
N-(1-cyanocyclopentyl)-3-methylpyridine-2-carboxamide
CID 55059760
6-chloro-N-(1-cyanocyclopentyl)pyridazine-3-carboxamide
CID 114036737
5-chloro-N-(1-cyanocyclooctyl)pyrazine-2-carboxamide
CID 107248634
6-chloro-N-(3-cyanothiolan-3-yl)pyridine-2-carboxamide
CID 62234577
N-(1-cyano-4-methylcyclohexyl)-6-methylpyridine-2-carboxamide
CID 61119929
N-[(2S)-2-cyano-3,4-dihydro-1H-naphthalen-2-yl]-4-(dimethylamino)pyridine-2-carboxamide
CID 99831684
N-(4-propan-2-yl-1-bicyclo[2.2.1]heptanyl)pyridine-2-carboxamide
CID 118410766
N-[1-(3-chlorophenyl)cyclopropyl]pyridine-2-carboxamide
CID 110444338
N-(1-cyanocyclopropyl)-1H-pyrrole-2-carboxamide
CID 130618816

Frequently Asked Questions

What is the IUPAC name of N-(1-cyanocyclopropyl)pyridine-2-carboxamide?
The IUPAC name of N-(1-cyanocyclopropyl)pyridine-2-carboxamide (CID 160579083) is N-(1-cyanocyclopropyl)pyridine-2-carboxamide.
What is the SMILES notation for N-(1-cyanocyclopropyl)pyridine-2-carboxamide?
The canonical SMILES for N-(1-cyanocyclopropyl)pyridine-2-carboxamide is N#CC1(NC(=O)c2ccccn2)CC1.
What is the InChIKey of N-(1-cyanocyclopropyl)pyridine-2-carboxamide?
The InChIKey is RBNNQLREVGECSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3O/c11-7-10(4-5-10)13-9(14)8-3-1-2-6-12-8/h1-3,6H,4-5H2,(H,13,14).
What are the key properties of N-(1-cyanocyclopropyl)pyridine-2-carboxamide?
N-(1-cyanocyclopropyl)pyridine-2-carboxamide has a molecular weight of 187.20 g/mol, XLogP of 0.87, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyanocyclopropyl)pyridine-2-carboxamide is sourced from PubChem (CID 160579083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).