5-(1H-indazol-3-yl)-N-phenyl-1H-pyrrole-3-carboxamide

C18H14N4O — CID 146637506

IUPAC5-(1H-indazol-3-yl)-N-phenyl-1H-pyrrole-3-carboxamide
SMILESO=C(Nc1ccccc1)c1c[nH]c(-c2n[nH]c3ccccc23)c1
InChIInChI=1S/C18H14N4O/c23-18(20-13-6-2-1-3-7-13)12-10-16(19-11-12)17-14-8-4-5-9-15(14)21-22-17/h1-11,19H,(H,20,23)(H,21,22)
InChIKeyJVAVZNIYTASBJH-UHFFFAOYSA-N
MW302.34 g/mol
LogP3.81
Rot. Bonds3

About 5-(1H-indazol-3-yl)-N-phenyl-1H-pyrrole-3-carboxamide

5-(1H-indazol-3-yl)-N-phenyl-1H-pyrrole-3-carboxamide (PubChem CID 146637506) has the molecular formula C18H14N4O and a molecular weight of 302.34 g/mol. Its IUPAC name is 5-(1H-indazol-3-yl)-N-phenyl-1H-pyrrole-3-carboxamide.

Molecular Properties

Compound Name5-(1H-indazol-3-yl)-N-phenyl-1H-pyrrole-3-carboxamide
PubChem CID146637506
Molecular FormulaC18H14N4O
Molecular Weight302.34 g/mol
Exact Mass302.12
IUPAC Name5-(1H-indazol-3-yl)-N-phenyl-1H-pyrrole-3-carboxamide
SMILESO=C(Nc1ccccc1)c1c[nH]c(-c2n[nH]c3ccccc23)c1
InChIInChI=1S/C18H14N4O/c23-18(20-13-6-2-1-3-7-13)12-10-16(19-11-12)17-14-8-4-5-9-15(14)21-22-17/h1-11,19H,(H,20,23)(H,21,22)
InChIKeyJVAVZNIYTASBJH-UHFFFAOYSA-N
XLogP3.81
TPSA73.57 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.34
LogP ≤ 53.81
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

4-(1H-indazol-3-yl)-N-phenylbenzamide
CID 146637903
5-(1H-indol-3-yl)-N-phenylfuran-3-carboxamide
CID 146637941
4-[(3-phenyl-1H-indazol-5-yl)carbamoyl]benzoic acid
CID 22479735
N-(3-chlorophenyl)-3-phenyl-1H-indazole-5-carboxamide
CID 162666626
2-(1H-indazol-3-yl)-1H-indole-6-carboxylic acid
CID 135445358
4-(1H-indol-3-yl)-N-phenylbenzamide
CID 146637660
2-[2-(1H-indazol-3-yl)ethenyl]-N-phenylbenzamide
CID 68996590
N-(3-acetamidophenyl)-1H-indazole-3-carboxamide
CID 9114494
5-(tert-butylamino)-N-phenyl-1H-pyrrole-3-carboxamide
CID 122693193
2-[4-[(3-phenyl-1H-indazol-5-yl)carbamoyl]phenyl]acetic acid
CID 142112726
2-chloro-N-[3-(1H-indazol-3-yl)phenyl]-4-methylsulfonylbenzamide
CID 50914465
2-[3-(1H-indazole-3-carbonylamino)phenyl]acetic acid
CID 170858284

Frequently Asked Questions

What is the IUPAC name of 5-(1H-indazol-3-yl)-N-phenyl-1H-pyrrole-3-carboxamide?
The IUPAC name of 5-(1H-indazol-3-yl)-N-phenyl-1H-pyrrole-3-carboxamide (CID 146637506) is 5-(1H-indazol-3-yl)-N-phenyl-1H-pyrrole-3-carboxamide.
What is the SMILES notation for 5-(1H-indazol-3-yl)-N-phenyl-1H-pyrrole-3-carboxamide?
The canonical SMILES for 5-(1H-indazol-3-yl)-N-phenyl-1H-pyrrole-3-carboxamide is O=C(Nc1ccccc1)c1c[nH]c(-c2n[nH]c3ccccc23)c1.
What is the InChIKey of 5-(1H-indazol-3-yl)-N-phenyl-1H-pyrrole-3-carboxamide?
The InChIKey is JVAVZNIYTASBJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N4O/c23-18(20-13-6-2-1-3-7-13)12-10-16(19-11-12)17-14-8-4-5-9-15(14)21-22-17/h1-11,19H,(H,20,23)(H,21,22).
What are the key properties of 5-(1H-indazol-3-yl)-N-phenyl-1H-pyrrole-3-carboxamide?
5-(1H-indazol-3-yl)-N-phenyl-1H-pyrrole-3-carboxamide has a molecular weight of 302.34 g/mol, XLogP of 3.81, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1H-indazol-3-yl)-N-phenyl-1H-pyrrole-3-carboxamide is sourced from PubChem (CID 146637506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).