N-hydroxy-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide

C8H11N3O2 — CID 130625748

IUPACN-hydroxy-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide
SMILESO=C(NO)C1CCCc2[nH]ncc21
InChIInChI=1S/C8H11N3O2/c12-8(11-13)5-2-1-3-7-6(5)4-9-10-7/h4-5,13H,1-3H2,(H,9,10)(H,11,12)
InChIKeyUKFNRKDFMADOQM-UHFFFAOYSA-N
MW181.19 g/mol
LogP0.34
Rot. Bonds1

About N-hydroxy-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide

N-hydroxy-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide (PubChem CID 130625748) has the molecular formula C8H11N3O2 and a molecular weight of 181.19 g/mol. Its IUPAC name is N-hydroxy-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide.

Molecular Properties

Compound NameN-hydroxy-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide
PubChem CID130625748
Molecular FormulaC8H11N3O2
Molecular Weight181.19 g/mol
Exact Mass181.09
IUPAC NameN-hydroxy-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide
SMILESO=C(NO)C1CCCc2[nH]ncc21
InChIInChI=1S/C8H11N3O2/c12-8(11-13)5-2-1-3-7-6(5)4-9-10-7/h4-5,13H,1-3H2,(H,9,10)(H,11,12)
InChIKeyUKFNRKDFMADOQM-UHFFFAOYSA-N
XLogP0.34
TPSA78.01 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.19
LogP ≤ 50.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-hydroxy-4,5,6,7-tetrahydro-1H-indazole-7-carboxamide
CID 126986453
N-[(3-hydroxycyclohexyl)methyl]-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide
CID 127458146
(4R)-N-(2-fluoro-4-hydroxyphenyl)-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide
CID 99782658
piperazin-1-yl(4,5,6,7-tetrahydro-1H-indazol-4-yl)methanone;hydrochloride
CID 119402457
2,4,5,5a,6,7,8,8a-octahydro-1H-cyclopenta[d]azepin-3-yl(4,5,6,7-tetrahydro-1H-indazol-4-yl)methanone
CID 155961845
(4S)-N-(5-methylthiophen-2-yl)sulfonyl-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide
CID 97223986
N-[(2-cyclobutyloxyphenyl)methyl]-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide
CID 126795440
N-[4-(1-methyl-1,2,4-triazol-3-yl)phenyl]-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide
CID 126766189
methyl (2R)-2-(4-fluorophenyl)-3-[[(4S)-4,5,6,7-tetrahydro-1H-indazole-4-carbonyl]amino]propanoate
CID 124624899
N-[2-(1-propan-2-yltriazol-4-yl)propan-2-yl]-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide
CID 154746273
(4S)-N-(5-ethylsulfonyl-2-hydroxyphenyl)-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide
CID 124576290
(4R)-N-[5-(2,3-difluorophenyl)-1H-pyrazol-3-yl]-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide
CID 97010653

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide?
The IUPAC name of N-hydroxy-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide (CID 130625748) is N-hydroxy-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide.
What is the SMILES notation for N-hydroxy-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide?
The canonical SMILES for N-hydroxy-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide is O=C(NO)C1CCCc2[nH]ncc21.
What is the InChIKey of N-hydroxy-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide?
The InChIKey is UKFNRKDFMADOQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O2/c12-8(11-13)5-2-1-3-7-6(5)4-9-10-7/h4-5,13H,1-3H2,(H,9,10)(H,11,12).
What are the key properties of N-hydroxy-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide?
N-hydroxy-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide has a molecular weight of 181.19 g/mol, XLogP of 0.34, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-4,5,6,7-tetrahydro-1H-indazole-4-carboxamide is sourced from PubChem (CID 130625748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).