2-[4-[(3R)-3-cyclopropylpiperidin-3-yl]phenyl]indazole-7-carboxamide

C22H24N4O — CID 146557119

IUPAC2-[4-[(3R)-3-cyclopropylpiperidin-3-yl]phenyl]indazole-7-carboxamide
SMILESNC(=O)c1cccc2cn(-c3ccc([C@]4(C5CC5)CCCNC4)cc3)nc12
InChIInChI=1S/C22H24N4O/c23-21(27)19-4-1-3-15-13-26(25-20(15)19)18-9-7-17(8-10-18)22(16-5-6-16)11-2-12-24-14-22/h1,3-4,7-10,13,16,24H,2,5-6,11-12,14H2,(H2,23,27)/t22-/m1/s1
InChIKeyNPLKYBJMAHZCNF-JOCHJYFZSA-N
MW360.46 g/mol
LogP3.16
Rot. Bonds4

About 2-[4-[(3R)-3-cyclopropylpiperidin-3-yl]phenyl]indazole-7-carboxamide

2-[4-[(3R)-3-cyclopropylpiperidin-3-yl]phenyl]indazole-7-carboxamide (PubChem CID 146557119) has the molecular formula C22H24N4O and a molecular weight of 360.46 g/mol. Its IUPAC name is 2-[4-[(3R)-3-cyclopropylpiperidin-3-yl]phenyl]indazole-7-carboxamide.

Molecular Properties

Compound Name2-[4-[(3R)-3-cyclopropylpiperidin-3-yl]phenyl]indazole-7-carboxamide
PubChem CID146557119
Molecular FormulaC22H24N4O
Molecular Weight360.46 g/mol
Exact Mass360.20
IUPAC Name2-[4-[(3R)-3-cyclopropylpiperidin-3-yl]phenyl]indazole-7-carboxamide
SMILESNC(=O)c1cccc2cn(-c3ccc([C@]4(C5CC5)CCCNC4)cc3)nc12
InChIInChI=1S/C22H24N4O/c23-21(27)19-4-1-3-15-13-26(25-20(15)19)18-9-7-17(8-10-18)22(16-5-6-16)11-2-12-24-14-22/h1,3-4,7-10,13,16,24H,2,5-6,11-12,14H2,(H2,23,27)/t22-/m1/s1
InChIKeyNPLKYBJMAHZCNF-JOCHJYFZSA-N
XLogP3.16
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.46
LogP ≤ 53.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

ethane;2-[4-[(3S)-piperidin-3-yl]phenyl]indazole-7-carboxamide
CID 176571066
2-[4-(5,5-dideuteriopiperidin-3-yl)phenyl]indazole-7-carboxamide
CID 154588348
2-[4-(2,2-dideuteriopiperidin-3-yl)phenyl]indazole-7-carboxamide
CID 154588339
2-[4-(2-deuteriopiperidin-3-yl)phenyl]indazole-7-carboxamide
CID 154588459
2-[4-[1-(1-hydroxypropyl)-3-azabicyclo[4.1.0]heptan-6-yl]phenyl]indazole-7-carboxamide
CID 118018100
5-fluoro-2-[4-[(3S)-3-fluoropiperidin-3-yl]phenyl]indazole-7-carboxamide
CID 146556789
2-[2,3,5,6-tetradeuterio-4-[(3S)-piperidin-3-yl]phenyl]indazole-7-carboxamide
CID 154588359
2-[4-[(3R,5S)-3,5-difluoropiperidin-3-yl]phenyl]indazole-7-carboxamide
CID 146557129
2-(4-cyclohexylphenyl)indazole-7-carboxamide
CID 129198392
2-[4-[1-(1-methoxypropyl)-3-azabicyclo[4.1.0]heptan-6-yl]phenyl]indazole-7-carboxamide
CID 118018094
2-[4-[1-(1-methoxybut-3-enyl)-3-azabicyclo[4.1.0]heptan-6-yl]phenyl]indazole-7-carboxamide
CID 118017855
2-[4-[(3S)-piperidin-3-yl]phenyl]indazole-7-carboxamide;3,3,3-trifluoropropanoic acid
CID 118451760

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(3R)-3-cyclopropylpiperidin-3-yl]phenyl]indazole-7-carboxamide?
The IUPAC name of 2-[4-[(3R)-3-cyclopropylpiperidin-3-yl]phenyl]indazole-7-carboxamide (CID 146557119) is 2-[4-[(3R)-3-cyclopropylpiperidin-3-yl]phenyl]indazole-7-carboxamide.
What is the SMILES notation for 2-[4-[(3R)-3-cyclopropylpiperidin-3-yl]phenyl]indazole-7-carboxamide?
The canonical SMILES for 2-[4-[(3R)-3-cyclopropylpiperidin-3-yl]phenyl]indazole-7-carboxamide is NC(=O)c1cccc2cn(-c3ccc([C@]4(C5CC5)CCCNC4)cc3)nc12.
What is the InChIKey of 2-[4-[(3R)-3-cyclopropylpiperidin-3-yl]phenyl]indazole-7-carboxamide?
The InChIKey is NPLKYBJMAHZCNF-JOCHJYFZSA-N. The full InChI is InChI=1S/C22H24N4O/c23-21(27)19-4-1-3-15-13-26(25-20(15)19)18-9-7-17(8-10-18)22(16-5-6-16)11-2-12-24-14-22/h1,3-4,7-10,13,16,24H,2,5-6,11-12,14H2,(H2,23,27)/t22-/m1/s1.
What are the key properties of 2-[4-[(3R)-3-cyclopropylpiperidin-3-yl]phenyl]indazole-7-carboxamide?
2-[4-[(3R)-3-cyclopropylpiperidin-3-yl]phenyl]indazole-7-carboxamide has a molecular weight of 360.46 g/mol, XLogP of 3.16, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(3R)-3-cyclopropylpiperidin-3-yl]phenyl]indazole-7-carboxamide is sourced from PubChem (CID 146557119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).