N-[4-(methylcarbamoyl)phenyl]-1H-indazole-3-carboxamide

C16H14N4O2 — CID 4799247

IUPACN-[4-(methylcarbamoyl)phenyl]-1H-indazole-3-carboxamide
SMILESCNC(=O)c1ccc(NC(=O)c2n[nH]c3ccccc23)cc1
InChIInChI=1S/C16H14N4O2/c1-17-15(21)10-6-8-11(9-7-10)18-16(22)14-12-4-2-3-5-13(12)19-20-14/h2-9H,1H3,(H,17,21)(H,18,22)(H,19,20)
InChIKeyWQBDHOFVUIPSGQ-UHFFFAOYSA-N
MW294.31 g/mol
LogP2.17
Rot. Bonds3

About N-[4-(methylcarbamoyl)phenyl]-1H-indazole-3-carboxamide

N-[4-(methylcarbamoyl)phenyl]-1H-indazole-3-carboxamide (PubChem CID 4799247) has the molecular formula C16H14N4O2 and a molecular weight of 294.31 g/mol. Its IUPAC name is N-[4-(methylcarbamoyl)phenyl]-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-[4-(methylcarbamoyl)phenyl]-1H-indazole-3-carboxamide
PubChem CID4799247
Molecular FormulaC16H14N4O2
Molecular Weight294.31 g/mol
Exact Mass294.11
IUPAC NameN-[4-(methylcarbamoyl)phenyl]-1H-indazole-3-carboxamide
SMILESCNC(=O)c1ccc(NC(=O)c2n[nH]c3ccccc23)cc1
InChIInChI=1S/C16H14N4O2/c1-17-15(21)10-6-8-11(9-7-10)18-16(22)14-12-4-2-3-5-13(12)19-20-14/h2-9H,1H3,(H,17,21)(H,18,22)(H,19,20)
InChIKeyWQBDHOFVUIPSGQ-UHFFFAOYSA-N
XLogP2.17
TPSA86.88 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.31
LogP ≤ 52.17
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-((1S)-1-(Aminocarbonyl)-2-methylpropyl)-1-((4-fluorophenyl)methyl)-1H-indazole-3-carboxamide
CID 58124325
Adb-butinaca
CID 155907792
5F-Cumyl-PINACA
CID 86274158
AB-Chminaca
CID 44206133
AB-Pinaca
CID 71301472
Facinicline
CID 9970357
N-(1-amino-3-methyl-1-oxobutan-2-yl)-1-pentyl-1H-indazole-3-carboxamide
CID 86567422
5-Fluoro-AB-pinaca, (A+-)-
CID 102144602
1-(4-cyanobutyl)-N-(2-phenylpropan-2-yl)-1H-indazole-3-carboxamide
CID 117650402
Adb-fubinaca
CID 58124399
Kw-2449
CID 11427553
App-butinaca
CID 154735174

Frequently Asked Questions

What is the IUPAC name of N-[4-(methylcarbamoyl)phenyl]-1H-indazole-3-carboxamide?
The IUPAC name of N-[4-(methylcarbamoyl)phenyl]-1H-indazole-3-carboxamide (CID 4799247) is N-[4-(methylcarbamoyl)phenyl]-1H-indazole-3-carboxamide.
What is the SMILES notation for N-[4-(methylcarbamoyl)phenyl]-1H-indazole-3-carboxamide?
The canonical SMILES for N-[4-(methylcarbamoyl)phenyl]-1H-indazole-3-carboxamide is CNC(=O)c1ccc(NC(=O)c2n[nH]c3ccccc23)cc1.
What is the InChIKey of N-[4-(methylcarbamoyl)phenyl]-1H-indazole-3-carboxamide?
The InChIKey is WQBDHOFVUIPSGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N4O2/c1-17-15(21)10-6-8-11(9-7-10)18-16(22)14-12-4-2-3-5-13(12)19-20-14/h2-9H,1H3,(H,17,21)(H,18,22)(H,19,20).
What are the key properties of N-[4-(methylcarbamoyl)phenyl]-1H-indazole-3-carboxamide?
N-[4-(methylcarbamoyl)phenyl]-1H-indazole-3-carboxamide has a molecular weight of 294.31 g/mol, XLogP of 2.17, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(methylcarbamoyl)phenyl]-1H-indazole-3-carboxamide is sourced from PubChem (CID 4799247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).