7-chloro-N-(5-methyl-2-phenylpyrazol-3-yl)-1H-indole-2-carboxamide

C19H15ClN4O — CID 108804103

IUPAC7-chloro-N-(5-methyl-2-phenylpyrazol-3-yl)-1H-indole-2-carboxamide
SMILESCc1cc(NC(=O)c2cc3cccc(Cl)c3[nH]2)n(-c2ccccc2)n1
InChIInChI=1S/C19H15ClN4O/c1-12-10-17(24(23-12)14-7-3-2-4-8-14)22-19(25)16-11-13-6-5-9-15(20)18(13)21-16/h2-11,21H,1H3,(H,22,25)
InChIKeyIIAHQWRTBZVBEM-UHFFFAOYSA-N
MW350.81 g/mol
LogP4.57
Rot. Bonds3

About 7-chloro-N-(5-methyl-2-phenylpyrazol-3-yl)-1H-indole-2-carboxamide

7-chloro-N-(5-methyl-2-phenylpyrazol-3-yl)-1H-indole-2-carboxamide (PubChem CID 108804103) has the molecular formula C19H15ClN4O and a molecular weight of 350.81 g/mol. Its IUPAC name is 7-chloro-N-(5-methyl-2-phenylpyrazol-3-yl)-1H-indole-2-carboxamide.

Molecular Properties

Compound Name7-chloro-N-(5-methyl-2-phenylpyrazol-3-yl)-1H-indole-2-carboxamide
PubChem CID108804103
Molecular FormulaC19H15ClN4O
Molecular Weight350.81 g/mol
Exact Mass350.09
IUPAC Name7-chloro-N-(5-methyl-2-phenylpyrazol-3-yl)-1H-indole-2-carboxamide
SMILESCc1cc(NC(=O)c2cc3cccc(Cl)c3[nH]2)n(-c2ccccc2)n1
InChIInChI=1S/C19H15ClN4O/c1-12-10-17(24(23-12)14-7-3-2-4-8-14)22-19(25)16-11-13-6-5-9-15(20)18(13)21-16/h2-11,21H,1H3,(H,22,25)
InChIKeyIIAHQWRTBZVBEM-UHFFFAOYSA-N
XLogP4.57
TPSA62.71 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.81
LogP ≤ 54.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3,4-dichloro-N-(5-methyl-2-phenylpyrazol-3-yl)benzamide
CID 11791835
2-chloro-3-methyl-N-(5-methyl-2-phenylpyrazol-3-yl)benzamide
CID 138993742
2-chloro-4-methyl-N-(5-methyl-2-phenylpyrazol-3-yl)benzamide
CID 139009806
5-chloro-N-(5-methyl-2-phenylpyrazol-3-yl)-2-pyrrolidin-1-ylpyrimidine-4-carboxamide
CID 138993580
2-chloro-4,5-dimethoxy-N-(5-methyl-2-phenylpyrazol-3-yl)benzamide
CID 138993021
4-chloro-N-[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]benzamide
CID 2352147
7-chloro-N-naphthalen-2-yl-1H-indole-2-carboxamide
CID 108791741
N-[2-(3-bromophenyl)-5-methylpyrazol-3-yl]-2,3-dichlorobenzamide
CID 55643391
3-chloro-6-ethoxy-N-(5-methyl-2-phenylpyrazol-3-yl)pyridine-2-carboxamide
CID 167792754
7-chloro-N-(2,6-diethylphenyl)-1H-indole-2-carboxamide
CID 108791658
2-chloro-N-(5-methyl-2-phenylpyrazol-3-yl)-5-(2-methylpropanoylamino)benzamide
CID 139003737
5-(4-chlorophenyl)-N-(5-methyl-2-phenylpyrazol-3-yl)-1,2-oxazole-3-carboxamide
CID 15988870

Frequently Asked Questions

What is the IUPAC name of 7-chloro-N-(5-methyl-2-phenylpyrazol-3-yl)-1H-indole-2-carboxamide?
The IUPAC name of 7-chloro-N-(5-methyl-2-phenylpyrazol-3-yl)-1H-indole-2-carboxamide (CID 108804103) is 7-chloro-N-(5-methyl-2-phenylpyrazol-3-yl)-1H-indole-2-carboxamide.
What is the SMILES notation for 7-chloro-N-(5-methyl-2-phenylpyrazol-3-yl)-1H-indole-2-carboxamide?
The canonical SMILES for 7-chloro-N-(5-methyl-2-phenylpyrazol-3-yl)-1H-indole-2-carboxamide is Cc1cc(NC(=O)c2cc3cccc(Cl)c3[nH]2)n(-c2ccccc2)n1.
What is the InChIKey of 7-chloro-N-(5-methyl-2-phenylpyrazol-3-yl)-1H-indole-2-carboxamide?
The InChIKey is IIAHQWRTBZVBEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15ClN4O/c1-12-10-17(24(23-12)14-7-3-2-4-8-14)22-19(25)16-11-13-6-5-9-15(20)18(13)21-16/h2-11,21H,1H3,(H,22,25).
What are the key properties of 7-chloro-N-(5-methyl-2-phenylpyrazol-3-yl)-1H-indole-2-carboxamide?
7-chloro-N-(5-methyl-2-phenylpyrazol-3-yl)-1H-indole-2-carboxamide has a molecular weight of 350.81 g/mol, XLogP of 4.57, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-N-(5-methyl-2-phenylpyrazol-3-yl)-1H-indole-2-carboxamide is sourced from PubChem (CID 108804103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).