N-[(2-methoxyphenyl)methyl]-1H-indazole-3-carboxamide

C16H15N3O2 — CID 2578297

IUPACN-[(2-methoxyphenyl)methyl]-1H-indazole-3-carboxamide
SMILESCOc1ccccc1CNC(=O)c1n[nH]c2ccccc12
InChIInChI=1S/C16H15N3O2/c1-21-14-9-5-2-6-11(14)10-17-16(20)15-12-7-3-4-8-13(12)18-19-15/h2-9H,10H2,1H3,(H,17,20)(H,18,19)
InChIKeyGMMPUMVNJWOVBB-UHFFFAOYSA-N
MW281.32 g/mol
LogP2.50
Rot. Bonds4

About N-[(2-methoxyphenyl)methyl]-1H-indazole-3-carboxamide

N-[(2-methoxyphenyl)methyl]-1H-indazole-3-carboxamide (PubChem CID 2578297) has the molecular formula C16H15N3O2 and a molecular weight of 281.32 g/mol. Its IUPAC name is N-[(2-methoxyphenyl)methyl]-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-[(2-methoxyphenyl)methyl]-1H-indazole-3-carboxamide
PubChem CID2578297
Molecular FormulaC16H15N3O2
Molecular Weight281.32 g/mol
Exact Mass281.12
IUPAC NameN-[(2-methoxyphenyl)methyl]-1H-indazole-3-carboxamide
SMILESCOc1ccccc1CNC(=O)c1n[nH]c2ccccc12
InChIInChI=1S/C16H15N3O2/c1-21-14-9-5-2-6-11(14)10-17-16(20)15-12-7-3-4-8-13(12)18-19-15/h2-9H,10H2,1H3,(H,17,20)(H,18,19)
InChIKeyGMMPUMVNJWOVBB-UHFFFAOYSA-N
XLogP2.50
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.32
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(2-hydroxy-3,5-dimethylphenyl)-N-(4-methoxybenzyl)-1H-pyrazole-3-carboxamide
CID 2031826
1H-indazol-3-yl-[4-(2-methoxyphenyl)piperazin-1-yl]methanone
CID 2572779
N-(4-methoxyphenyl)-2H-indazole-3-carboxamide
CID 9412007
N-[1-[3-(4-fluorophenoxy)propyl]piperidin-4-yl]-1-propan-2-ylindazole-3-carboxamide
CID 9867783
N-(3-methoxyphenyl)-1H-indazole-3-carboxamide
CID 16866354
1-[(2R)-4-benzoyl-2-methylpiperazin-1-yl]-2-[(3-methyl-2H-indazol-4-yl)oxy]propan-1-one
CID 45487308
5-methoxy-N-{[1-(2-methoxyethyl)-piperidin-4-yl]methyl}-1H-indazole-3-carboxamide
CID 71714627
4-[4-({[(5-methoxy-1H-indazol-3-yl)carbonyl]amino}methyl)piperidin-1-yl]butanoic acid
CID 71714654
5-methoxy-N-[(1-{3-[(phenylcarbonyl)amino]propyl}piperidin-4-yl)methyl]-1H-indazole-3-carboxamide
CID 71714698
N-({1-[3-(butanoylamino)propyl] piperidin-4-yl}methyl)-5-methoxy-1H-indazole-3-carboxamide
CID 71714699
N-[(1-{3-[(2E)-but-2-enoylamino]propyl}piperidin-4-yl)methyl]-5-methoxy-1H-indazole-3-carboxamide
CID 71714700
5-methoxy-N-({1-[3-(propanoylamino) propyl]piperidin-4-yl}methyl)-1H-indazole-3-carboxamide
CID 71714701

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxyphenyl)methyl]-1H-indazole-3-carboxamide?
The IUPAC name of N-[(2-methoxyphenyl)methyl]-1H-indazole-3-carboxamide (CID 2578297) is N-[(2-methoxyphenyl)methyl]-1H-indazole-3-carboxamide.
What is the SMILES notation for N-[(2-methoxyphenyl)methyl]-1H-indazole-3-carboxamide?
The canonical SMILES for N-[(2-methoxyphenyl)methyl]-1H-indazole-3-carboxamide is COc1ccccc1CNC(=O)c1n[nH]c2ccccc12.
What is the InChIKey of N-[(2-methoxyphenyl)methyl]-1H-indazole-3-carboxamide?
The InChIKey is GMMPUMVNJWOVBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O2/c1-21-14-9-5-2-6-11(14)10-17-16(20)15-12-7-3-4-8-13(12)18-19-15/h2-9H,10H2,1H3,(H,17,20)(H,18,19).
What are the key properties of N-[(2-methoxyphenyl)methyl]-1H-indazole-3-carboxamide?
N-[(2-methoxyphenyl)methyl]-1H-indazole-3-carboxamide has a molecular weight of 281.32 g/mol, XLogP of 2.50, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxyphenyl)methyl]-1H-indazole-3-carboxamide is sourced from PubChem (CID 2578297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).