N-methyl-N-(3-methylphenyl)-1H-indazole-3-carboxamide

C16H15N3O — CID 62949104

IUPACN-methyl-N-(3-methylphenyl)-1H-indazole-3-carboxamide
SMILESCc1cccc(N(C)C(=O)c2n[nH]c3ccccc23)c1
InChIInChI=1S/C16H15N3O/c1-11-6-5-7-12(10-11)19(2)16(20)15-13-8-3-4-9-14(13)17-18-15/h3-10H,1-2H3,(H,17,18)
InChIKeyNKJOHTIYRQNXTN-UHFFFAOYSA-N
MW265.32 g/mol
LogP3.15
Rot. Bonds2

About N-methyl-N-(3-methylphenyl)-1H-indazole-3-carboxamide

N-methyl-N-(3-methylphenyl)-1H-indazole-3-carboxamide (PubChem CID 62949104) has the molecular formula C16H15N3O and a molecular weight of 265.32 g/mol. Its IUPAC name is N-methyl-N-(3-methylphenyl)-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(3-methylphenyl)-1H-indazole-3-carboxamide
PubChem CID62949104
Molecular FormulaC16H15N3O
Molecular Weight265.32 g/mol
Exact Mass265.12
IUPAC NameN-methyl-N-(3-methylphenyl)-1H-indazole-3-carboxamide
SMILESCc1cccc(N(C)C(=O)c2n[nH]c3ccccc23)c1
InChIInChI=1S/C16H15N3O/c1-11-6-5-7-12(10-11)19(2)16(20)15-13-8-3-4-9-14(13)17-18-15/h3-10H,1-2H3,(H,17,18)
InChIKeyNKJOHTIYRQNXTN-UHFFFAOYSA-N
XLogP3.15
TPSA48.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-hydroxyphenyl)-N-methyl-1H-indazole-3-carboxamide
CID 107735760
N-methyl-N-pyridin-2-yl-1H-indazole-3-carboxamide
CID 64983096
ethane;N-methoxy-N-methyl-1H-indazole-3-carboxamide
CID 142077122
2-[1H-indazole-3-carbonyl(methyl)amino]-2-methylpropanoic acid
CID 62818630
1-(1H-indazol-3-yl)ethanone
CID 15684169
N-methyl-N-(2-pyrrolidin-1-ylethyl)-1H-indazole-3-carboxamide
CID 63239690
N-methyl-N-(2-methylbutyl)-1H-indazole-3-carboxamide
CID 63932230
5-amino-N-(4-hydroxyphenyl)-N-methyl-1H-indazole-3-carboxamide
CID 107733029
N-[(4-fluorophenyl)methyl]-N-methyl-1H-indazole-3-carboxamide
CID 51162817
3-[1H-indazole-3-carbonyl(methyl)amino]-2-methylpropanoic acid
CID 55008009
N-[(2-chlorophenyl)methyl]-N-methyl-1H-indazole-3-carboxamide
CID 7537965
N-[(4-bromophenyl)methyl]-N-methyl-1H-indazole-3-carboxamide
CID 43003333

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(3-methylphenyl)-1H-indazole-3-carboxamide?
The IUPAC name of N-methyl-N-(3-methylphenyl)-1H-indazole-3-carboxamide (CID 62949104) is N-methyl-N-(3-methylphenyl)-1H-indazole-3-carboxamide.
What is the SMILES notation for N-methyl-N-(3-methylphenyl)-1H-indazole-3-carboxamide?
The canonical SMILES for N-methyl-N-(3-methylphenyl)-1H-indazole-3-carboxamide is Cc1cccc(N(C)C(=O)c2n[nH]c3ccccc23)c1.
What is the InChIKey of N-methyl-N-(3-methylphenyl)-1H-indazole-3-carboxamide?
The InChIKey is NKJOHTIYRQNXTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O/c1-11-6-5-7-12(10-11)19(2)16(20)15-13-8-3-4-9-14(13)17-18-15/h3-10H,1-2H3,(H,17,18).
What are the key properties of N-methyl-N-(3-methylphenyl)-1H-indazole-3-carboxamide?
N-methyl-N-(3-methylphenyl)-1H-indazole-3-carboxamide has a molecular weight of 265.32 g/mol, XLogP of 3.15, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(3-methylphenyl)-1H-indazole-3-carboxamide is sourced from PubChem (CID 62949104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).