N-[(1,3-dimethylpyrazol-4-yl)methyl]-1H-indazole-3-carboxamide

C14H15N5O — CID 115991487

IUPACN-[(1,3-dimethylpyrazol-4-yl)methyl]-1H-indazole-3-carboxamide
SMILESCc1nn(C)cc1CNC(=O)c1n[nH]c2ccccc12
InChIInChI=1S/C14H15N5O/c1-9-10(8-19(2)18-9)7-15-14(20)13-11-5-3-4-6-12(11)16-17-13/h3-6,8H,7H2,1-2H3,(H,15,20)(H,16,17)
InChIKeyLFJPHLDFYNVIJO-UHFFFAOYSA-N
MW269.31 g/mol
LogP1.53
Rot. Bonds3

About N-[(1,3-dimethylpyrazol-4-yl)methyl]-1H-indazole-3-carboxamide

N-[(1,3-dimethylpyrazol-4-yl)methyl]-1H-indazole-3-carboxamide (PubChem CID 115991487) has the molecular formula C14H15N5O and a molecular weight of 269.31 g/mol. Its IUPAC name is N-[(1,3-dimethylpyrazol-4-yl)methyl]-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-[(1,3-dimethylpyrazol-4-yl)methyl]-1H-indazole-3-carboxamide
PubChem CID115991487
Molecular FormulaC14H15N5O
Molecular Weight269.31 g/mol
Exact Mass269.13
IUPAC NameN-[(1,3-dimethylpyrazol-4-yl)methyl]-1H-indazole-3-carboxamide
SMILESCc1nn(C)cc1CNC(=O)c1n[nH]c2ccccc12
InChIInChI=1S/C14H15N5O/c1-9-10(8-19(2)18-9)7-15-14(20)13-11-5-3-4-6-12(11)16-17-13/h3-6,8H,7H2,1-2H3,(H,15,20)(H,16,17)
InChIKeyLFJPHLDFYNVIJO-UHFFFAOYSA-N
XLogP1.53
TPSA75.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.31
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1,3-dimethylpyrazol-4-yl)methyl]-2-phenylacetamide
CID 19288393
2-[(1,3-dimethylpyrazol-4-yl)methylcarbamoyl]benzoic acid
CID 115989224
2-(2-aminophenyl)-N-[(1,3-dimethylpyrazol-4-yl)methyl]acetamide
CID 112668170
N-[(1,3-dimethylpyrazol-4-yl)methyl]-2-fluorobenzamide
CID 112668766
N-[(4-fluoro-3-methylphenyl)methyl]-1H-indazole-3-carboxamide
CID 37017710
N-[(2-chlorophenyl)methyl]-1H-indazole-3-carboxamide;N-[(4-methylphenyl)methyl]-1H-indazole-3-carboxamide
CID 69079053
N-[(1,3-dimethylpyrazol-4-yl)methyl]acetamide;ethane
CID 142558548
N-[(1,3-dimethylpyrazol-4-yl)methyl]-2-phenoxyacetamide
CID 42352426
N-[2-[(4-methylphenyl)methylamino]-2-oxoethyl]-1H-indazole-3-carboxamide
CID 170858384
N-[(1,3-dimethylpyrazol-4-yl)methyl]-5-ethyl-1H-1,2,4-triazole-3-carboxamide
CID 112671881
N-[(4-acetamidophenyl)methyl]-1H-indazole-3-carboxamide
CID 18154228
N-(2-methylpropyl)-1H-indazole-3-carboxamide
CID 42477800

Frequently Asked Questions

What is the IUPAC name of N-[(1,3-dimethylpyrazol-4-yl)methyl]-1H-indazole-3-carboxamide?
The IUPAC name of N-[(1,3-dimethylpyrazol-4-yl)methyl]-1H-indazole-3-carboxamide (CID 115991487) is N-[(1,3-dimethylpyrazol-4-yl)methyl]-1H-indazole-3-carboxamide.
What is the SMILES notation for N-[(1,3-dimethylpyrazol-4-yl)methyl]-1H-indazole-3-carboxamide?
The canonical SMILES for N-[(1,3-dimethylpyrazol-4-yl)methyl]-1H-indazole-3-carboxamide is Cc1nn(C)cc1CNC(=O)c1n[nH]c2ccccc12.
What is the InChIKey of N-[(1,3-dimethylpyrazol-4-yl)methyl]-1H-indazole-3-carboxamide?
The InChIKey is LFJPHLDFYNVIJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5O/c1-9-10(8-19(2)18-9)7-15-14(20)13-11-5-3-4-6-12(11)16-17-13/h3-6,8H,7H2,1-2H3,(H,15,20)(H,16,17).
What are the key properties of N-[(1,3-dimethylpyrazol-4-yl)methyl]-1H-indazole-3-carboxamide?
N-[(1,3-dimethylpyrazol-4-yl)methyl]-1H-indazole-3-carboxamide has a molecular weight of 269.31 g/mol, XLogP of 1.53, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1,3-dimethylpyrazol-4-yl)methyl]-1H-indazole-3-carboxamide is sourced from PubChem (CID 115991487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).