N-[4-(cyanomethoxy)phenyl]pyridine-2-carboxamide

C14H11N3O2 — CID 30874024

IUPACN-[4-(cyanomethoxy)phenyl]pyridine-2-carboxamide
SMILESN#CCOc1ccc(NC(=O)c2ccccn2)cc1
InChIInChI=1S/C14H11N3O2/c15-8-10-19-12-6-4-11(5-7-12)17-14(18)13-3-1-2-9-16-13/h1-7,9H,10H2,(H,17,18)
InChIKeyQDRLYKVJUBLRER-UHFFFAOYSA-N
MW253.26 g/mol
LogP2.24
Rot. Bonds4

About N-[4-(cyanomethoxy)phenyl]pyridine-2-carboxamide

N-[4-(cyanomethoxy)phenyl]pyridine-2-carboxamide (PubChem CID 30874024) has the molecular formula C14H11N3O2 and a molecular weight of 253.26 g/mol. Its IUPAC name is N-[4-(cyanomethoxy)phenyl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[4-(cyanomethoxy)phenyl]pyridine-2-carboxamide
PubChem CID30874024
Molecular FormulaC14H11N3O2
Molecular Weight253.26 g/mol
Exact Mass253.09
IUPAC NameN-[4-(cyanomethoxy)phenyl]pyridine-2-carboxamide
SMILESN#CCOc1ccc(NC(=O)c2ccccn2)cc1
InChIInChI=1S/C14H11N3O2/c15-8-10-19-12-6-4-11(5-7-12)17-14(18)13-3-1-2-9-16-13/h1-7,9H,10H2,(H,17,18)
InChIKeyQDRLYKVJUBLRER-UHFFFAOYSA-N
XLogP2.24
TPSA75.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.26
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[4-(cyanomethoxy)phenyl]pyridine-2-carboxamide 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

2-bromo-N-[4-(cyanomethoxy)phenyl]pyridine-3-carboxamide
CID 103751975
N-(4-methoxyphenyl)pyridine-2-carboxamide
CID 821516
N-[4-(cyanomethoxy)phenyl]-4-(phenylcarbamoylamino)benzamide
CID 55372952
N-[4-(cyanomethoxy)phenyl]-1-methylimidazole-4-carboxamide
CID 103858045
1-benzyl-N-[4-(cyanomethoxy)phenyl]triazole-4-carboxamide
CID 31867870
N-(4-hexoxyphenyl)pyridine-2-carboxamide
CID 17353110
3-chloro-N-[4-(cyanomethoxy)phenyl]benzamide
CID 30874096
N-[4-(cyanomethoxy)phenyl]-2-(trifluoromethylsulfanyl)pyridine-3-carboxamide
CID 47847759
4-(carbamoylamino)-N-[4-(cyanomethoxy)phenyl]benzamide
CID 26114223
N-[4-(3-hydroxyprop-1-ynyl)phenyl]pyridine-2-carboxamide
CID 60802763
N-[4-(cyanomethoxy)phenyl]-3,5-dihydroxybenzamide
CID 107703130
3,5-dibromo-N-[4-(cyanomethoxy)phenyl]benzamide
CID 103907443

Frequently Asked Questions

What is the IUPAC name of N-[4-(cyanomethoxy)phenyl]pyridine-2-carboxamide?
The IUPAC name of N-[4-(cyanomethoxy)phenyl]pyridine-2-carboxamide (CID 30874024) is N-[4-(cyanomethoxy)phenyl]pyridine-2-carboxamide.
What is the SMILES notation for N-[4-(cyanomethoxy)phenyl]pyridine-2-carboxamide?
The canonical SMILES for N-[4-(cyanomethoxy)phenyl]pyridine-2-carboxamide is N#CCOc1ccc(NC(=O)c2ccccn2)cc1.
What is the InChIKey of N-[4-(cyanomethoxy)phenyl]pyridine-2-carboxamide?
The InChIKey is QDRLYKVJUBLRER-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N3O2/c15-8-10-19-12-6-4-11(5-7-12)17-14(18)13-3-1-2-9-16-13/h1-7,9H,10H2,(H,17,18).
What are the key properties of N-[4-(cyanomethoxy)phenyl]pyridine-2-carboxamide?
N-[4-(cyanomethoxy)phenyl]pyridine-2-carboxamide has a molecular weight of 253.26 g/mol, XLogP of 2.24, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(cyanomethoxy)phenyl]pyridine-2-carboxamide is sourced from PubChem (CID 30874024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).