N-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide

C11H9N5O — CID 53486940

IUPACN-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide
SMILESO=C(Nc1cn[nH]c1)c1cc2cccnc2[nH]1
InChIInChI=1S/C11H9N5O/c17-11(15-8-5-13-14-6-8)9-4-7-2-1-3-12-10(7)16-9/h1-6H,(H,12,16)(H,13,14)(H,15,17)
InChIKeyKKBCGRGXTYMSEA-UHFFFAOYSA-N
MW227.23 g/mol
LogP1.54
Rot. Bonds2

About N-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide

N-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide (PubChem CID 53486940) has the molecular formula C11H9N5O and a molecular weight of 227.23 g/mol. Its IUPAC name is N-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide
PubChem CID53486940
Molecular FormulaC11H9N5O
Molecular Weight227.23 g/mol
Exact Mass227.08
IUPAC NameN-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide
SMILESO=C(Nc1cn[nH]c1)c1cc2cccnc2[nH]1
InChIInChI=1S/C11H9N5O/c17-11(15-8-5-13-14-6-8)9-4-7-2-1-3-12-10(7)16-9/h1-6H,(H,12,16)(H,13,14)(H,15,17)
InChIKeyKKBCGRGXTYMSEA-UHFFFAOYSA-N
XLogP1.54
TPSA86.46 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.23
LogP ≤ 51.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]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

N-naphthalen-2-yl-1H-pyrrolo[2,3-b]pyridine-2-carboxamide
CID 141390644
N-(2,6-dichlorophenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide
CID 141390705
N-(1H-pyrazol-4-yl)pyridine-3-carboxamide
CID 20784957
molecular hydrogen;1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid
CID 156715490
N-(1H-pyrazol-4-yl)-4H-thieno[3,2-b]pyrrole-5-carboxamide
CID 166222045
N-(1H-pyrazol-4-yl)-6-[2-(pyrrolidin-1-ylmethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide
CID 172895646
N-(2-chloro-6-methylphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide
CID 141390702
N-(4-fluoro-2-methylphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide
CID 141390704
N,N-dimethyl-1H-pyrrolo[2,3-b]pyridine-2-carboxamide
CID 122648492
2-amino-N-(1H-pyrazol-4-yl)pyridine-4-carboxamide
CID 62154464
4-hydroxy-N-(1H-pyrazol-4-yl)benzamide
CID 43540288
4-methoxy-N-(1H-pyrazol-4-yl)benzamide
CID 43429414

Frequently Asked Questions

What is the IUPAC name of N-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide?
The IUPAC name of N-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide (CID 53486940) is N-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide.
What is the SMILES notation for N-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide?
The canonical SMILES for N-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide is O=C(Nc1cn[nH]c1)c1cc2cccnc2[nH]1.
What is the InChIKey of N-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide?
The InChIKey is KKBCGRGXTYMSEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N5O/c17-11(15-8-5-13-14-6-8)9-4-7-2-1-3-12-10(7)16-9/h1-6H,(H,12,16)(H,13,14)(H,15,17).
What are the key properties of N-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide?
N-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide has a molecular weight of 227.23 g/mol, XLogP of 1.54, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 53486940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).