1-benzoyl-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)piperidine-4-carboxamide

C20H24N4O2 — CID 136515751

IUPAC1-benzoyl-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)piperidine-4-carboxamide
SMILESO=C(NC1CCCc2cn[nH]c21)C1CCN(C(=O)c2ccccc2)CC1
InChIInChI=1S/C20H24N4O2/c25-19(22-17-8-4-7-16-13-21-23-18(16)17)14-9-11-24(12-10-14)20(26)15-5-2-1-3-6-15/h1-3,5-6,13-14,17H,4,7-12H2,(H,21,23)(H,22,25)
InChIKeyNFXQKHLHJOPSRT-UHFFFAOYSA-N
MW352.44 g/mol
LogP2.46
Rot. Bonds3

About 1-benzoyl-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)piperidine-4-carboxamide

1-benzoyl-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)piperidine-4-carboxamide (PubChem CID 136515751) has the molecular formula C20H24N4O2 and a molecular weight of 352.44 g/mol. Its IUPAC name is 1-benzoyl-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-benzoyl-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)piperidine-4-carboxamide
PubChem CID136515751
Molecular FormulaC20H24N4O2
Molecular Weight352.44 g/mol
Exact Mass352.19
IUPAC Name1-benzoyl-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)piperidine-4-carboxamide
SMILESO=C(NC1CCCc2cn[nH]c21)C1CCN(C(=O)c2ccccc2)CC1
InChIInChI=1S/C20H24N4O2/c25-19(22-17-8-4-7-16-13-21-23-18(16)17)14-9-11-24(12-10-14)20(26)15-5-2-1-3-6-15/h1-3,5-6,13-14,17H,4,7-12H2,(H,21,23)(H,22,25)
InChIKeyNFXQKHLHJOPSRT-UHFFFAOYSA-N
XLogP2.46
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.44
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-phenyl-3-[(7S)-4,5,6,7-tetrahydro-1H-indazol-7-yl]urea
CID 97228997
N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)pyrrolidine-3-carboxamide
CID 119787830
1-(4-methylbenzoyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide
CID 131896030
3-amino-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)cyclohexane-1-carboxamide
CID 119787796
4-N-(5-methyl-1,2-oxazol-3-yl)-1-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)piperidine-1,4-dicarboxamide
CID 127597421
2-methyl-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)oxane-3-carboxamide
CID 138043861
N-(1-benzoylpiperidin-4-yl)cyclopentanecarboxamide
CID 110820191
3-amino-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)bicyclo[2.2.1]heptane-2-carboxamide;hydrochloride
CID 119787793
3-amino-3-phenyl-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)propanamide;hydrochloride
CID 119951600
4-[(4,5,6,7-tetrahydro-1H-indazol-7-ylamino)methyl]benzoic acid
CID 122032052
3-methyl-1-(4,5,6,7-tetrahydro-1H-indazol-7-ylcarbamoyl)pyrrolidine-3-carboxylic acid
CID 122007005
N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1-[1-[4-(trifluoromethyl)benzoyl]piperidin-4-yl]piperidine-4-carboxamide
CID 42693551

Frequently Asked Questions

What is the IUPAC name of 1-benzoyl-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)piperidine-4-carboxamide?
The IUPAC name of 1-benzoyl-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)piperidine-4-carboxamide (CID 136515751) is 1-benzoyl-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)piperidine-4-carboxamide.
What is the SMILES notation for 1-benzoyl-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)piperidine-4-carboxamide?
The canonical SMILES for 1-benzoyl-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)piperidine-4-carboxamide is O=C(NC1CCCc2cn[nH]c21)C1CCN(C(=O)c2ccccc2)CC1.
What is the InChIKey of 1-benzoyl-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)piperidine-4-carboxamide?
The InChIKey is NFXQKHLHJOPSRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O2/c25-19(22-17-8-4-7-16-13-21-23-18(16)17)14-9-11-24(12-10-14)20(26)15-5-2-1-3-6-15/h1-3,5-6,13-14,17H,4,7-12H2,(H,21,23)(H,22,25).
What are the key properties of 1-benzoyl-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)piperidine-4-carboxamide?
1-benzoyl-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)piperidine-4-carboxamide has a molecular weight of 352.44 g/mol, XLogP of 2.46, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzoyl-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)piperidine-4-carboxamide is sourced from PubChem (CID 136515751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).