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

C18H19N3O2 — CID 38836920

IUPACN-[(1R)-1-(2-methoxyphenyl)propyl]-1H-indazole-3-carboxamide
SMILESCC[C@@H](NC(=O)c1n[nH]c2ccccc12)c1ccccc1OC
InChIInChI=1S/C18H19N3O2/c1-3-14(12-8-5-7-11-16(12)23-2)19-18(22)17-13-9-4-6-10-15(13)20-21-17/h4-11,14H,3H2,1-2H3,(H,19,22)(H,20,21)/t14-/m1/s1
InChIKeyMBBICMRFLXEECR-CQSZACIVSA-N
MW309.37 g/mol
LogP3.45
Rot. Bonds5

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

N-[(1R)-1-(2-methoxyphenyl)propyl]-1H-indazole-3-carboxamide (PubChem CID 38836920) has the molecular formula C18H19N3O2 and a molecular weight of 309.37 g/mol. Its IUPAC name is N-[(1R)-1-(2-methoxyphenyl)propyl]-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-[(1R)-1-(2-methoxyphenyl)propyl]-1H-indazole-3-carboxamide
PubChem CID38836920
Molecular FormulaC18H19N3O2
Molecular Weight309.37 g/mol
Exact Mass309.15
IUPAC NameN-[(1R)-1-(2-methoxyphenyl)propyl]-1H-indazole-3-carboxamide
SMILESCC[C@@H](NC(=O)c1n[nH]c2ccccc12)c1ccccc1OC
InChIInChI=1S/C18H19N3O2/c1-3-14(12-8-5-7-11-16(12)23-2)19-18(22)17-13-9-4-6-10-15(13)20-21-17/h4-11,14H,3H2,1-2H3,(H,19,22)(H,20,21)/t14-/m1/s1
InChIKeyMBBICMRFLXEECR-CQSZACIVSA-N
XLogP3.45
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(2-methoxyphenoxy)ethyl]-1H-indazole-3-carboxamide
CID 4785814
N-[1-(2,5-dimethoxyphenyl)ethyl]-1H-indazole-3-carboxamide
CID 17397509
N-[1-(2-methoxy-5-methylphenyl)ethyl]-1H-indazole-3-carboxamide
CID 17462645
N-(3-ethylpentan-2-yl)-1H-indazole-3-carboxamide
CID 63851037
N-(1-ethoxyethyl)-1H-indazole-3-carboxamide
CID 57149113
N-(1-methoxypropan-2-yl)-1H-indazole-3-carboxamide
CID 18161172
N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-1H-indazole-3-carboxamide
CID 51109530
2-bromo-N-[1-(2-methoxyphenyl)propyl]butanamide
CID 62855577
N-(2-ethoxyphenyl)-1H-indazole-3-carboxamide
CID 16866355
2-[(1H-indazole-3-carbonylamino)methyl]-3-(2-methoxyphenyl)propanoic acid
CID 170858615
N-[2-(2,3-dimethoxyphenyl)-2-(1H-indol-3-yl)ethyl]-1H-indazole-3-carboxamide
CID 60589031
N-methoxy-1H-indazole-3-carboxamide
CID 60722689

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-(2-methoxyphenyl)propyl]-1H-indazole-3-carboxamide?
The IUPAC name of N-[(1R)-1-(2-methoxyphenyl)propyl]-1H-indazole-3-carboxamide (CID 38836920) is N-[(1R)-1-(2-methoxyphenyl)propyl]-1H-indazole-3-carboxamide.
What is the SMILES notation for N-[(1R)-1-(2-methoxyphenyl)propyl]-1H-indazole-3-carboxamide?
The canonical SMILES for N-[(1R)-1-(2-methoxyphenyl)propyl]-1H-indazole-3-carboxamide is CC[C@@H](NC(=O)c1n[nH]c2ccccc12)c1ccccc1OC.
What is the InChIKey of N-[(1R)-1-(2-methoxyphenyl)propyl]-1H-indazole-3-carboxamide?
The InChIKey is MBBICMRFLXEECR-CQSZACIVSA-N. The full InChI is InChI=1S/C18H19N3O2/c1-3-14(12-8-5-7-11-16(12)23-2)19-18(22)17-13-9-4-6-10-15(13)20-21-17/h4-11,14H,3H2,1-2H3,(H,19,22)(H,20,21)/t14-/m1/s1.
What are the key properties of N-[(1R)-1-(2-methoxyphenyl)propyl]-1H-indazole-3-carboxamide?
N-[(1R)-1-(2-methoxyphenyl)propyl]-1H-indazole-3-carboxamide has a molecular weight of 309.37 g/mol, XLogP of 3.45, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-(2-methoxyphenyl)propyl]-1H-indazole-3-carboxamide is sourced from PubChem (CID 38836920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).