3-[(1H-indazol-6-ylamino)methyl]benzamide

C15H14N4O — CID 63277483

IUPAC3-[(1H-indazol-6-ylamino)methyl]benzamide
SMILESNC(=O)c1cccc(CNc2ccc3cn[nH]c3c2)c1
InChIInChI=1S/C15H14N4O/c16-15(20)11-3-1-2-10(6-11)8-17-13-5-4-12-9-18-19-14(12)7-13/h1-7,9,17H,8H2,(H2,16,20)(H,18,19)
InChIKeyIWYYELWRSIELST-UHFFFAOYSA-N
MW266.30 g/mol
LogP2.27
Rot. Bonds4

About 3-[(1H-indazol-6-ylamino)methyl]benzamide

3-[(1H-indazol-6-ylamino)methyl]benzamide (PubChem CID 63277483) has the molecular formula C15H14N4O and a molecular weight of 266.30 g/mol. Its IUPAC name is 3-[(1H-indazol-6-ylamino)methyl]benzamide.

Molecular Properties

Compound Name3-[(1H-indazol-6-ylamino)methyl]benzamide
PubChem CID63277483
Molecular FormulaC15H14N4O
Molecular Weight266.30 g/mol
Exact Mass266.12
IUPAC Name3-[(1H-indazol-6-ylamino)methyl]benzamide
SMILESNC(=O)c1cccc(CNc2ccc3cn[nH]c3c2)c1
InChIInChI=1S/C15H14N4O/c16-15(20)11-3-1-2-10(6-11)8-17-13-5-4-12-9-18-19-14(12)7-13/h1-7,9,17H,8H2,(H2,16,20)(H,18,19)
InChIKeyIWYYELWRSIELST-UHFFFAOYSA-N
XLogP2.27
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 52.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 3-[(1H-indazol-6-ylamino)methyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]methyl]benzamide
CID 63277343
3-[(naphthalen-2-ylamino)methyl]benzamide
CID 43533069
2-[3-[(1H-indazol-6-ylamino)methyl]phenoxy]acetonitrile
CID 43790594
N-[(3,4-dimethylphenyl)methyl]-1H-indazol-6-amine
CID 43790642
3-[(4-tert-butylanilino)methyl]benzamide
CID 28572040
N-[(4-ethylphenyl)methyl]-1H-indazol-6-amine
CID 43743407
3-[[(6-methoxy-3-pyridinyl)amino]methyl]benzamide
CID 28564635
3-[[(5-methyl-3-pyridinyl)amino]methyl]benzamide
CID 103824002
3-[(4-chloro-3-fluoroanilino)methyl]benzamide
CID 61467366
3-[(3-bromo-4-methylanilino)methyl]benzamide
CID 55201932
3-[(3,5-difluoroanilino)methyl]benzamide
CID 28584265
3-[(3,5-dichloroanilino)methyl]benzamide
CID 28576195

Frequently Asked Questions

What is the IUPAC name of 3-[(1H-indazol-6-ylamino)methyl]benzamide?
The IUPAC name of 3-[(1H-indazol-6-ylamino)methyl]benzamide (CID 63277483) is 3-[(1H-indazol-6-ylamino)methyl]benzamide.
What is the SMILES notation for 3-[(1H-indazol-6-ylamino)methyl]benzamide?
The canonical SMILES for 3-[(1H-indazol-6-ylamino)methyl]benzamide is NC(=O)c1cccc(CNc2ccc3cn[nH]c3c2)c1.
What is the InChIKey of 3-[(1H-indazol-6-ylamino)methyl]benzamide?
The InChIKey is IWYYELWRSIELST-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O/c16-15(20)11-3-1-2-10(6-11)8-17-13-5-4-12-9-18-19-14(12)7-13/h1-7,9,17H,8H2,(H2,16,20)(H,18,19).
What are the key properties of 3-[(1H-indazol-6-ylamino)methyl]benzamide?
3-[(1H-indazol-6-ylamino)methyl]benzamide has a molecular weight of 266.30 g/mol, XLogP of 2.27, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(1H-indazol-6-ylamino)methyl]benzamide is sourced from PubChem (CID 63277483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).