N-[(1S,2R,4R)-7-azabicyclo[2.2.1]heptan-2-yl]-1H-indazole-5-carboxamide

C14H16N4O — CID 10377709

IUPACN-[(1S,2R,4R)-7-azabicyclo[2.2.1]heptan-2-yl]-1H-indazole-5-carboxamide
SMILESO=C(N[C@@H]1C[C@H]2CC[C@@H]1N2)c1ccc2[nH]ncc2c1
InChIInChI=1S/C14H16N4O/c19-14(17-13-6-10-2-4-12(13)16-10)8-1-3-11-9(5-8)7-15-18-11/h1,3,5,7,10,12-13,16H,2,4,6H2,(H,15,18)(H,17,19)/t10-,12+,13-/m1/s1
InChIKeyWBHDTVSQZXJOFU-KGYLQXTDSA-N
MW256.31 g/mol
LogP1.19
Rot. Bonds2

About N-[(1S,2R,4R)-7-azabicyclo[2.2.1]heptan-2-yl]-1H-indazole-5-carboxamide

N-[(1S,2R,4R)-7-azabicyclo[2.2.1]heptan-2-yl]-1H-indazole-5-carboxamide (PubChem CID 10377709) has the molecular formula C14H16N4O and a molecular weight of 256.31 g/mol. Its IUPAC name is N-[(1S,2R,4R)-7-azabicyclo[2.2.1]heptan-2-yl]-1H-indazole-5-carboxamide.

Molecular Properties

Compound NameN-[(1S,2R,4R)-7-azabicyclo[2.2.1]heptan-2-yl]-1H-indazole-5-carboxamide
PubChem CID10377709
Molecular FormulaC14H16N4O
Molecular Weight256.31 g/mol
Exact Mass256.13
IUPAC NameN-[(1S,2R,4R)-7-azabicyclo[2.2.1]heptan-2-yl]-1H-indazole-5-carboxamide
SMILESO=C(N[C@@H]1C[C@H]2CC[C@@H]1N2)c1ccc2[nH]ncc2c1
InChIInChI=1S/C14H16N4O/c19-14(17-13-6-10-2-4-12(13)16-10)8-1-3-11-9(5-8)7-15-18-11/h1,3,5,7,10,12-13,16H,2,4,6H2,(H,15,18)(H,17,19)/t10-,12+,13-/m1/s1
InChIKeyWBHDTVSQZXJOFU-KGYLQXTDSA-N
XLogP1.19
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 51.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-[(1S,2R,4R)-7-azabicyclo[2.2.1]heptan-2-yl]-1H-indazole-5-carboxamide with MolForge

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Related Compounds

(3-(3,3-dimethylbutyl)pyrrolidin-3-yl)(1H-indazol-5-yl)methanone
CID 49866041
N-[3-(1h-Tetrazol-5-Yl)phenyl]-2h-Indazole-5-Carboxamide
CID 56851706
2-[8-(2~{H}-indazol-5-ylcarbonyl)-4-oxidanylidene-1-phenyl-1,3,8-triazaspiro[4.5]decan-3-yl]-~{N}-methyl-ethanamide
CID 134540391
N-cyclopropyl-3-(1H-indazol-5-yl)-4-methylbenzamide
CID 10469531
n-Phenyl-1h-indazole-5-carboxamide
CID 22933429
N-(1-benzylpiperidin-4-yl)-1H-indazole-5-carboxamide
CID 22933917
2-(4-(2-(pyrrolidin-1-yl)ethylcarbamoyl)phenyl)-2H-indazole-7-carboxamide
CID 46226265
(1H-indazol-5-yl)(2-propylpyrrolidin-2-yl)methanone
CID 49865878
(1H-indazol-5-yl)(2-isobutylpyrrolidin-2-yl)methanone
CID 49865879
(2-(3,3-dimethylbutyl)pyrrolidin-2-yl)(1H-indazol-5-yl)methanone
CID 49865880
2-tert-butyl-1'-(1H-indazole-5-carbonyl)spiro[4,6-dihydropyrazolo[3,4-c]pyridine-5,4'-piperidine]-7-one
CID 56967888
N-(3,4-difluorophenyl)-1H-indazole-5-carboxamide
CID 77844665

Frequently Asked Questions

What is the IUPAC name of N-[(1S,2R,4R)-7-azabicyclo[2.2.1]heptan-2-yl]-1H-indazole-5-carboxamide?
The IUPAC name of N-[(1S,2R,4R)-7-azabicyclo[2.2.1]heptan-2-yl]-1H-indazole-5-carboxamide (CID 10377709) is N-[(1S,2R,4R)-7-azabicyclo[2.2.1]heptan-2-yl]-1H-indazole-5-carboxamide.
What is the SMILES notation for N-[(1S,2R,4R)-7-azabicyclo[2.2.1]heptan-2-yl]-1H-indazole-5-carboxamide?
The canonical SMILES for N-[(1S,2R,4R)-7-azabicyclo[2.2.1]heptan-2-yl]-1H-indazole-5-carboxamide is O=C(N[C@@H]1C[C@H]2CC[C@@H]1N2)c1ccc2[nH]ncc2c1.
What is the InChIKey of N-[(1S,2R,4R)-7-azabicyclo[2.2.1]heptan-2-yl]-1H-indazole-5-carboxamide?
The InChIKey is WBHDTVSQZXJOFU-KGYLQXTDSA-N. The full InChI is InChI=1S/C14H16N4O/c19-14(17-13-6-10-2-4-12(13)16-10)8-1-3-11-9(5-8)7-15-18-11/h1,3,5,7,10,12-13,16H,2,4,6H2,(H,15,18)(H,17,19)/t10-,12+,13-/m1/s1.
What are the key properties of N-[(1S,2R,4R)-7-azabicyclo[2.2.1]heptan-2-yl]-1H-indazole-5-carboxamide?
N-[(1S,2R,4R)-7-azabicyclo[2.2.1]heptan-2-yl]-1H-indazole-5-carboxamide has a molecular weight of 256.31 g/mol, XLogP of 1.19, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S,2R,4R)-7-azabicyclo[2.2.1]heptan-2-yl]-1H-indazole-5-carboxamide is sourced from PubChem (CID 10377709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).