N-[2-[(dimethylamino)methyl]phenyl]-1H-indazole-7-carboxamide

C17H18N4O — CID 38436270

IUPACN-[2-[(dimethylamino)methyl]phenyl]-1H-indazole-7-carboxamide
SMILESCN(C)Cc1ccccc1NC(=O)c1cccc2cn[nH]c12
InChIInChI=1S/C17H18N4O/c1-21(2)11-13-6-3-4-9-15(13)19-17(22)14-8-5-7-12-10-18-20-16(12)14/h3-10H,11H2,1-2H3,(H,18,20)(H,19,22)
InChIKeyQPQGHDXVYCSJLF-UHFFFAOYSA-N
MW294.36 g/mol
LogP2.88
Rot. Bonds4

About N-[2-[(dimethylamino)methyl]phenyl]-1H-indazole-7-carboxamide

N-[2-[(dimethylamino)methyl]phenyl]-1H-indazole-7-carboxamide (PubChem CID 38436270) has the molecular formula C17H18N4O and a molecular weight of 294.36 g/mol. Its IUPAC name is N-[2-[(dimethylamino)methyl]phenyl]-1H-indazole-7-carboxamide.

Molecular Properties

Compound NameN-[2-[(dimethylamino)methyl]phenyl]-1H-indazole-7-carboxamide
PubChem CID38436270
Molecular FormulaC17H18N4O
Molecular Weight294.36 g/mol
Exact Mass294.15
IUPAC NameN-[2-[(dimethylamino)methyl]phenyl]-1H-indazole-7-carboxamide
SMILESCN(C)Cc1ccccc1NC(=O)c1cccc2cn[nH]c12
InChIInChI=1S/C17H18N4O/c1-21(2)11-13-6-3-4-9-15(13)19-17(22)14-8-5-7-12-10-18-20-16(12)14/h3-10H,11H2,1-2H3,(H,18,20)(H,19,22)
InChIKeyQPQGHDXVYCSJLF-UHFFFAOYSA-N
XLogP2.88
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.36
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1H-indazol-7-yl)-2-(methylamino)benzamide
CID 61376523
2-N,6-N-bis[2-[(dimethylamino)methyl]phenyl]pyridine-2,6-dicarboxamide
CID 38435626
N'-methyl-N'-phenyl-1H-indazole-7-carbohydrazide
CID 69242941
N-(2,4-dimethoxyphenyl)-1H-indazole-7-carboxamide
CID 36805049
N-[2-(4-hydroxypiperidin-1-yl)phenyl]-1H-indazole-7-carboxamide
CID 110901915
2,3-difluoro-N-(1H-indazol-7-yl)benzamide
CID 62661069
N-(1H-indazol-7-yl)-2-methylpropanamide
CID 31817153
methyl 3-(1H-indazole-7-carbonylamino)-4-methylbenzoate
CID 43048612
N-[2-[(dimethylamino)methyl]phenyl]-3-hydroxybenzamide
CID 110472375
6-bromo-N-[2-[(dimethylamino)methyl]phenyl]pyridine-3-carboxamide
CID 66464873
4-chloro-N-[2-[(dimethylamino)methyl]phenyl]-6-methylpyridine-3-carboxamide
CID 81227997
N-(1H-indazol-7-ylmethyl)-N-methylhydroxylamine
CID 96741733

Frequently Asked Questions

What is the IUPAC name of N-[2-[(dimethylamino)methyl]phenyl]-1H-indazole-7-carboxamide?
The IUPAC name of N-[2-[(dimethylamino)methyl]phenyl]-1H-indazole-7-carboxamide (CID 38436270) is N-[2-[(dimethylamino)methyl]phenyl]-1H-indazole-7-carboxamide.
What is the SMILES notation for N-[2-[(dimethylamino)methyl]phenyl]-1H-indazole-7-carboxamide?
The canonical SMILES for N-[2-[(dimethylamino)methyl]phenyl]-1H-indazole-7-carboxamide is CN(C)Cc1ccccc1NC(=O)c1cccc2cn[nH]c12.
What is the InChIKey of N-[2-[(dimethylamino)methyl]phenyl]-1H-indazole-7-carboxamide?
The InChIKey is QPQGHDXVYCSJLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4O/c1-21(2)11-13-6-3-4-9-15(13)19-17(22)14-8-5-7-12-10-18-20-16(12)14/h3-10H,11H2,1-2H3,(H,18,20)(H,19,22).
What are the key properties of N-[2-[(dimethylamino)methyl]phenyl]-1H-indazole-7-carboxamide?
N-[2-[(dimethylamino)methyl]phenyl]-1H-indazole-7-carboxamide has a molecular weight of 294.36 g/mol, XLogP of 2.88, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(dimethylamino)methyl]phenyl]-1H-indazole-7-carboxamide is sourced from PubChem (CID 38436270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).