N-(6-methylspiro[3.3]heptan-2-yl)-1H-indazole-7-carboxamide

C16H19N3O — CID 170258466

IUPACN-(6-methylspiro[3.3]heptan-2-yl)-1H-indazole-7-carboxamide
SMILESCC1CC2(C1)CC(NC(=O)c1cccc3cn[nH]c13)C2
InChIInChI=1S/C16H19N3O/c1-10-5-16(6-10)7-12(8-16)18-15(20)13-4-2-3-11-9-17-19-14(11)13/h2-4,9-10,12H,5-8H2,1H3,(H,17,19)(H,18,20)
InChIKeyXQDWJEQMMXLNEX-UHFFFAOYSA-N
MW269.35 g/mol
LogP2.87
Rot. Bonds2

About N-(6-methylspiro[3.3]heptan-2-yl)-1H-indazole-7-carboxamide

N-(6-methylspiro[3.3]heptan-2-yl)-1H-indazole-7-carboxamide (PubChem CID 170258466) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is N-(6-methylspiro[3.3]heptan-2-yl)-1H-indazole-7-carboxamide.

Molecular Properties

Compound NameN-(6-methylspiro[3.3]heptan-2-yl)-1H-indazole-7-carboxamide
PubChem CID170258466
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC NameN-(6-methylspiro[3.3]heptan-2-yl)-1H-indazole-7-carboxamide
SMILESCC1CC2(C1)CC(NC(=O)c1cccc3cn[nH]c13)C2
InChIInChI=1S/C16H19N3O/c1-10-5-16(6-10)7-12(8-16)18-15(20)13-4-2-3-11-9-17-19-14(11)13/h2-4,9-10,12H,5-8H2,1H3,(H,17,19)(H,18,20)
InChIKeyXQDWJEQMMXLNEX-UHFFFAOYSA-N
XLogP2.87
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(5-methyl-2-propan-2-ylcyclohexyl)-1H-indazole-7-carboxamide
CID 60547804
N-[(2R)-1-azabicyclo[2.2.2]octan-2-yl]-1H-indazole-7-carboxamide
CID 69229027
N-[(2R)-1-azabicyclo[2.2.2]octan-2-yl]-1H-indazole-7-carboxamide;hydrochloride
CID 69229026
methyl (4S)-4-(1H-indazole-7-carbonylamino)spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate
CID 153495831
N-(2-cyclopentyl-2-hydroxyethyl)-1H-indazole-7-carboxamide
CID 111426218
4-(1H-indazole-7-carbonylamino)spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylic acid
CID 146585142
N'-methyl-N'-phenyl-1H-indazole-7-carbohydrazide
CID 69242941
N-[4-[[2-(trifluoromethyl)imidazo[1,2-a]pyridin-5-yl]amino]cyclohexyl]-1H-indazole-7-carboxamide
CID 164558388
N-[4-[[2-(2-fluoropropan-2-yl)-6-methylquinolin-4-yl]amino]cyclohexyl]-1H-indazole-7-carboxamide
CID 167099537
N-[2-[(dimethylamino)methyl]phenyl]-1H-indazole-7-carboxamide
CID 38436270
propan-2-yl 3-(1H-indazole-7-carbonylamino)propanoate
CID 47150573
trans-(1S,2S)-N-(1H-indazol-7-yl)-2-methylcyclopropane-1-carboxamide
CID 34148096

Frequently Asked Questions

What is the IUPAC name of N-(6-methylspiro[3.3]heptan-2-yl)-1H-indazole-7-carboxamide?
The IUPAC name of N-(6-methylspiro[3.3]heptan-2-yl)-1H-indazole-7-carboxamide (CID 170258466) is N-(6-methylspiro[3.3]heptan-2-yl)-1H-indazole-7-carboxamide.
What is the SMILES notation for N-(6-methylspiro[3.3]heptan-2-yl)-1H-indazole-7-carboxamide?
The canonical SMILES for N-(6-methylspiro[3.3]heptan-2-yl)-1H-indazole-7-carboxamide is CC1CC2(C1)CC(NC(=O)c1cccc3cn[nH]c13)C2.
What is the InChIKey of N-(6-methylspiro[3.3]heptan-2-yl)-1H-indazole-7-carboxamide?
The InChIKey is XQDWJEQMMXLNEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-10-5-16(6-10)7-12(8-16)18-15(20)13-4-2-3-11-9-17-19-14(11)13/h2-4,9-10,12H,5-8H2,1H3,(H,17,19)(H,18,20).
What are the key properties of N-(6-methylspiro[3.3]heptan-2-yl)-1H-indazole-7-carboxamide?
N-(6-methylspiro[3.3]heptan-2-yl)-1H-indazole-7-carboxamide has a molecular weight of 269.35 g/mol, XLogP of 2.87, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methylspiro[3.3]heptan-2-yl)-1H-indazole-7-carboxamide is sourced from PubChem (CID 170258466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).