N-(4-carbamoyl-1H-pyrazol-5-yl)-1H-indole-2-carboxamide

C13H11N5O2 — CID 110474036

IUPACN-(4-carbamoyl-1H-pyrazol-5-yl)-1H-indole-2-carboxamide
SMILESNC(=O)c1cn[nH]c1NC(=O)c1cc2ccccc2[nH]1
InChIInChI=1S/C13H11N5O2/c14-11(19)8-6-15-18-12(8)17-13(20)10-5-7-3-1-2-4-9(7)16-10/h1-6,16H,(H2,14,19)(H2,15,17,18,20)
InChIKeyNVTBNMGYYWRZPP-UHFFFAOYSA-N
MW269.26 g/mol
LogP1.24
Rot. Bonds3

About N-(4-carbamoyl-1H-pyrazol-5-yl)-1H-indole-2-carboxamide

N-(4-carbamoyl-1H-pyrazol-5-yl)-1H-indole-2-carboxamide (PubChem CID 110474036) has the molecular formula C13H11N5O2 and a molecular weight of 269.26 g/mol. Its IUPAC name is N-(4-carbamoyl-1H-pyrazol-5-yl)-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-(4-carbamoyl-1H-pyrazol-5-yl)-1H-indole-2-carboxamide
PubChem CID110474036
Molecular FormulaC13H11N5O2
Molecular Weight269.26 g/mol
Exact Mass269.09
IUPAC NameN-(4-carbamoyl-1H-pyrazol-5-yl)-1H-indole-2-carboxamide
SMILESNC(=O)c1cn[nH]c1NC(=O)c1cc2ccccc2[nH]1
InChIInChI=1S/C13H11N5O2/c14-11(19)8-6-15-18-12(8)17-13(20)10-5-7-3-1-2-4-9(7)16-10/h1-6,16H,(H2,14,19)(H2,15,17,18,20)
InChIKeyNVTBNMGYYWRZPP-UHFFFAOYSA-N
XLogP1.24
TPSA116.66 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.26
LogP ≤ 51.24
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

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Related Compounds

5-(1H-indole-2-carbonylamino)-1H-pyrazole-4-carboxylic acid
CID 110481756
(1H-indole-2-carbonylamino)thiourea
CID 15483527
N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-1H-indole-2-carboxamide
CID 42982780
N-(5-bromo-1,3-thiazol-2-yl)-1H-indole-2-carboxamide
CID 60784651
N-pyrazin-2-yl-1H-indole-2-carboxamide
CID 43422742
N-(4-bromo-2-pyridinyl)-1H-indole-2-carboxamide
CID 102674192
N-(6-bromo-3-pyridinyl)-1H-indole-2-carboxamide
CID 103789422
2-hydroxy-5-(1H-indole-2-carbonylamino)benzoic acid
CID 43823296
potassium N-oxido-1H-indole-2-carboxamide
CID 23661896
N-(4-methyl-1,2,4-triazol-3-yl)-1H-indole-2-carboxamide
CID 86815562
N-(5-bromo-6-methyl-2-pyridinyl)-1H-indole-2-carboxamide
CID 79049257
2-(sulfinatocarbamoyl)-1H-indole
CID 174607158

Frequently Asked Questions

What is the IUPAC name of N-(4-carbamoyl-1H-pyrazol-5-yl)-1H-indole-2-carboxamide?
The IUPAC name of N-(4-carbamoyl-1H-pyrazol-5-yl)-1H-indole-2-carboxamide (CID 110474036) is N-(4-carbamoyl-1H-pyrazol-5-yl)-1H-indole-2-carboxamide.
What is the SMILES notation for N-(4-carbamoyl-1H-pyrazol-5-yl)-1H-indole-2-carboxamide?
The canonical SMILES for N-(4-carbamoyl-1H-pyrazol-5-yl)-1H-indole-2-carboxamide is NC(=O)c1cn[nH]c1NC(=O)c1cc2ccccc2[nH]1.
What is the InChIKey of N-(4-carbamoyl-1H-pyrazol-5-yl)-1H-indole-2-carboxamide?
The InChIKey is NVTBNMGYYWRZPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N5O2/c14-11(19)8-6-15-18-12(8)17-13(20)10-5-7-3-1-2-4-9(7)16-10/h1-6,16H,(H2,14,19)(H2,15,17,18,20).
What are the key properties of N-(4-carbamoyl-1H-pyrazol-5-yl)-1H-indole-2-carboxamide?
N-(4-carbamoyl-1H-pyrazol-5-yl)-1H-indole-2-carboxamide has a molecular weight of 269.26 g/mol, XLogP of 1.24, 3 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-carbamoyl-1H-pyrazol-5-yl)-1H-indole-2-carboxamide is sourced from PubChem (CID 110474036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).