1-[(2,4-dichlorophenyl)methyl]indazole-3-carboxamide

C15H11Cl2N3O — CID 11537039

IUPAC1-[(2,4-dichlorophenyl)methyl]indazole-3-carboxamide
SMILESNC(=O)c1nn(Cc2ccc(Cl)cc2Cl)c2ccccc12
InChIInChI=1S/C15H11Cl2N3O/c16-10-6-5-9(12(17)7-10)8-20-13-4-2-1-3-11(13)14(19-20)15(18)21/h1-7H,8H2,(H2,18,21)
InChIKeyFLSYKVXUOPGGQI-UHFFFAOYSA-N
MW320.18 g/mol
LogP3.49
Rot. Bonds3

About 1-[(2,4-dichlorophenyl)methyl]indazole-3-carboxamide

1-[(2,4-dichlorophenyl)methyl]indazole-3-carboxamide (PubChem CID 11537039) has the molecular formula C15H11Cl2N3O and a molecular weight of 320.18 g/mol. Its IUPAC name is 1-[(2,4-dichlorophenyl)methyl]indazole-3-carboxamide.

Molecular Properties

Compound Name1-[(2,4-dichlorophenyl)methyl]indazole-3-carboxamide
PubChem CID11537039
Molecular FormulaC15H11Cl2N3O
Molecular Weight320.18 g/mol
Exact Mass319.03
IUPAC Name1-[(2,4-dichlorophenyl)methyl]indazole-3-carboxamide
SMILESNC(=O)c1nn(Cc2ccc(Cl)cc2Cl)c2ccccc12
InChIInChI=1S/C15H11Cl2N3O/c16-10-6-5-9(12(17)7-10)8-20-13-4-2-1-3-11(13)14(19-20)15(18)21/h1-7H,8H2,(H2,18,21)
InChIKeyFLSYKVXUOPGGQI-UHFFFAOYSA-N
XLogP3.49
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.18
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-[(2,4-dichlorophenyl)methyl]indazol-3-yl]prop-2-enoic acid
CID 67610724
1-[1-[(2,4-dichlorophenyl)methyl]indazol-3-yl]nonan-1-one;hydrobromide
CID 160720537
1-[(2,4-dichlorophenyl)methyl]-N-(3,4-difluorophenyl)indazole-3-carboxamide
CID 11704695
3-[1-[(2,4-dichlorophenyl)methyl]indazol-3-yl]propanehydrazide
CID 162374177
1-[(2,4-dichlorophenyl)methyl]-N-[(2S,4S)-1-hydroxy-4-methylhexan-2-yl]indazole-3-carboxamide
CID 146222514
azane;1-[(2,4-dichlorophenyl)methyl]indazole-3-carboxylic acid;dichloroplatinum(2+);bis(hexanoate)
CID 53255360
methyl 6-chloro-1-[(2,4-dichlorophenyl)methyl]indazole-3-carboxylate
CID 66887924
1-[[4-chloro-2-(trifluoromethyl)phenyl]methyl]indazole-3-carboxylic acid
CID 58796837
5-amino-1-[(2,4-dichlorophenyl)methyl]triazole-4-carboxamide
CID 14662861
3-[1-[(2,4-dichlorophenyl)methyl]indazol-3-yl]benzohydrazide
CID 162374180
1-[(2,4-dichlorophenyl)methyl]-5-iodoindazole-3-carboxylic acid
CID 71216306
[5-[[1-[(2,4-dichlorophenyl)methyl]indazole-3-carbonyl]amino]-3-methylpentyl]-triphenylphosphanium bromide
CID 162305899

Frequently Asked Questions

What is the IUPAC name of 1-[(2,4-dichlorophenyl)methyl]indazole-3-carboxamide?
The IUPAC name of 1-[(2,4-dichlorophenyl)methyl]indazole-3-carboxamide (CID 11537039) is 1-[(2,4-dichlorophenyl)methyl]indazole-3-carboxamide.
What is the SMILES notation for 1-[(2,4-dichlorophenyl)methyl]indazole-3-carboxamide?
The canonical SMILES for 1-[(2,4-dichlorophenyl)methyl]indazole-3-carboxamide is NC(=O)c1nn(Cc2ccc(Cl)cc2Cl)c2ccccc12.
What is the InChIKey of 1-[(2,4-dichlorophenyl)methyl]indazole-3-carboxamide?
The InChIKey is FLSYKVXUOPGGQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11Cl2N3O/c16-10-6-5-9(12(17)7-10)8-20-13-4-2-1-3-11(13)14(19-20)15(18)21/h1-7H,8H2,(H2,18,21).
What are the key properties of 1-[(2,4-dichlorophenyl)methyl]indazole-3-carboxamide?
1-[(2,4-dichlorophenyl)methyl]indazole-3-carboxamide has a molecular weight of 320.18 g/mol, XLogP of 3.49, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2,4-dichlorophenyl)methyl]indazole-3-carboxamide is sourced from PubChem (CID 11537039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).