phenyl N-[5-cyano-6-(triazol-2-yl)-3-pyridinyl]carbamate

C15H10N6O2 — CID 155201986

IUPACphenyl N-[5-cyano-6-(triazol-2-yl)-3-pyridinyl]carbamate
SMILESN#Cc1cc(NC(=O)Oc2ccccc2)cnc1-n1nccn1
InChIInChI=1S/C15H10N6O2/c16-9-11-8-12(10-17-14(11)21-18-6-7-19-21)20-15(22)23-13-4-2-1-3-5-13/h1-8,10H,(H,20,22)
InChIKeyOSSIZQSWFOHWDR-UHFFFAOYSA-N
MW306.29 g/mol
LogP2.14
Rot. Bonds3

About phenyl N-[5-cyano-6-(triazol-2-yl)-3-pyridinyl]carbamate

phenyl N-[5-cyano-6-(triazol-2-yl)-3-pyridinyl]carbamate (PubChem CID 155201986) has the molecular formula C15H10N6O2 and a molecular weight of 306.29 g/mol. Its IUPAC name is phenyl N-[5-cyano-6-(triazol-2-yl)-3-pyridinyl]carbamate.

Molecular Properties

Compound Namephenyl N-[5-cyano-6-(triazol-2-yl)-3-pyridinyl]carbamate
PubChem CID155201986
Molecular FormulaC15H10N6O2
Molecular Weight306.29 g/mol
Exact Mass306.09
IUPAC Namephenyl N-[5-cyano-6-(triazol-2-yl)-3-pyridinyl]carbamate
SMILESN#Cc1cc(NC(=O)Oc2ccccc2)cnc1-n1nccn1
InChIInChI=1S/C15H10N6O2/c16-9-11-8-12(10-17-14(11)21-18-6-7-19-21)20-15(22)23-13-4-2-1-3-5-13/h1-8,10H,(H,20,22)
InChIKeyOSSIZQSWFOHWDR-UHFFFAOYSA-N
XLogP2.14
TPSA105.72 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.29
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze phenyl N-[5-cyano-6-(triazol-2-yl)-3-pyridinyl]carbamate 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

phenyl N-(3-cyano-2-pyridinyl)carbamate
CID 110472420
phenyl N-(4-cyano-1-methylpyrazol-5-yl)carbamate
CID 79503955
N-[5-cyano-6-(triazol-2-yl)-3-pyridinyl]formamide
CID 164599964
1-(3-chloro-2-pyridinyl)-N-[5-cyano-6-(triazol-2-yl)-3-pyridinyl]-5-(trifluoromethyl)pyrazole-4-carboxamide
CID 146285264
phenyl N-(6-fluoro-3-pyridinyl)carbamate
CID 59313675
phenyl N-(5-cyano-2-pyridinyl)carbamate
CID 57469773
1-(2-cyano-4-fluorophenyl)-N-[5-cyano-6-(triazol-2-yl)-3-pyridinyl]-5-(trifluoromethyl)pyrazole-4-carboxamide
CID 146285366
N-[5-cyano-6-(triazol-2-yl)-3-pyridinyl]-1-(3,4-dichloro-2-pyridinyl)-5-(trifluoromethyl)pyrazole-4-carboxamide
CID 146285083
N-[5-cyano-6-(triazol-2-yl)-3-pyridinyl]-1-(2,4-difluorophenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide
CID 146285151
phenyl N-(6-nitro-3-pyridinyl)carbamate
CID 141417930
phenyl N-[5-(2-cyclopropylethynyl)-6-(1,1-difluoroethyl)-3-pyridinyl]carbamate
CID 176654544
phenyl N-[6-(hydroxymethyl)-3-pyridinyl]carbamate
CID 86676127

Frequently Asked Questions

What is the IUPAC name of phenyl N-[5-cyano-6-(triazol-2-yl)-3-pyridinyl]carbamate?
The IUPAC name of phenyl N-[5-cyano-6-(triazol-2-yl)-3-pyridinyl]carbamate (CID 155201986) is phenyl N-[5-cyano-6-(triazol-2-yl)-3-pyridinyl]carbamate.
What is the SMILES notation for phenyl N-[5-cyano-6-(triazol-2-yl)-3-pyridinyl]carbamate?
The canonical SMILES for phenyl N-[5-cyano-6-(triazol-2-yl)-3-pyridinyl]carbamate is N#Cc1cc(NC(=O)Oc2ccccc2)cnc1-n1nccn1.
What is the InChIKey of phenyl N-[5-cyano-6-(triazol-2-yl)-3-pyridinyl]carbamate?
The InChIKey is OSSIZQSWFOHWDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N6O2/c16-9-11-8-12(10-17-14(11)21-18-6-7-19-21)20-15(22)23-13-4-2-1-3-5-13/h1-8,10H,(H,20,22).
What are the key properties of phenyl N-[5-cyano-6-(triazol-2-yl)-3-pyridinyl]carbamate?
phenyl N-[5-cyano-6-(triazol-2-yl)-3-pyridinyl]carbamate has a molecular weight of 306.29 g/mol, XLogP of 2.14, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl N-[5-cyano-6-(triazol-2-yl)-3-pyridinyl]carbamate is sourced from PubChem (CID 155201986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).