N-(5-oxopyrrolidin-3-yl)-1H-indazole-6-carboxamide

C12H12N4O2 — CID 114156980

IUPACN-(5-oxopyrrolidin-3-yl)-1H-indazole-6-carboxamide
SMILESO=C1CC(NC(=O)c2ccc3cn[nH]c3c2)CN1
InChIInChI=1S/C12H12N4O2/c17-11-4-9(6-13-11)15-12(18)7-1-2-8-5-14-16-10(8)3-7/h1-3,5,9H,4,6H2,(H,13,17)(H,14,16)(H,15,18)
InChIKeyKDRTZCOGGKOLKV-UHFFFAOYSA-N
MW244.25 g/mol
LogP0.18
Rot. Bonds2

About N-(5-oxopyrrolidin-3-yl)-1H-indazole-6-carboxamide

N-(5-oxopyrrolidin-3-yl)-1H-indazole-6-carboxamide (PubChem CID 114156980) has the molecular formula C12H12N4O2 and a molecular weight of 244.25 g/mol. Its IUPAC name is N-(5-oxopyrrolidin-3-yl)-1H-indazole-6-carboxamide.

Molecular Properties

Compound NameN-(5-oxopyrrolidin-3-yl)-1H-indazole-6-carboxamide
PubChem CID114156980
Molecular FormulaC12H12N4O2
Molecular Weight244.25 g/mol
Exact Mass244.10
IUPAC NameN-(5-oxopyrrolidin-3-yl)-1H-indazole-6-carboxamide
SMILESO=C1CC(NC(=O)c2ccc3cn[nH]c3c2)CN1
InChIInChI=1S/C12H12N4O2/c17-11-4-9(6-13-11)15-12(18)7-1-2-8-5-14-16-10(8)3-7/h1-3,5,9H,4,6H2,(H,13,17)(H,14,16)(H,15,18)
InChIKeyKDRTZCOGGKOLKV-UHFFFAOYSA-N
XLogP0.18
TPSA86.88 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.25
LogP ≤ 50.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-methylpiperidin-4-yl)-1H-indazole-6-carboxamide
CID 62905083
3-[(5-oxopyrrolidin-3-yl)carbamoyl]benzoic acid
CID 114156972
3-(1H-indazole-6-carbonylamino)cyclohexane-1-carboxylic acid
CID 63043468
N-(1-methyl-6-oxopiperidin-3-yl)-1H-indazole-6-carboxamide
CID 64667250
N-(2-azabicyclo[2.2.1]heptan-5-yl)-1H-indazole-6-carboxamide
CID 10192822
N-(1-methylpiperidin-3-yl)-1H-indazole-6-carboxamide
CID 55133135
N-(1-benzamidopyrrolidin-3-yl)-1H-indazole-6-carboxamide
CID 137456634
N-(5-oxopyrrolidin-3-yl)-2,3-dihydro-1H-indene-5-carboxamide
CID 112534753
N-(5-oxopyrrolidin-3-yl)-4-sulfanylbenzamide
CID 106198052
N-(1-propylpiperidin-4-yl)-1H-indazole-6-carboxamide
CID 60715287
4-bromo-3-fluoro-N-(5-oxopyrrolidin-3-yl)benzamide
CID 103951495
N-(5-oxopyrrolidin-3-yl)-1,3-benzodioxole-5-carboxamide
CID 56765647

Frequently Asked Questions

What is the IUPAC name of N-(5-oxopyrrolidin-3-yl)-1H-indazole-6-carboxamide?
The IUPAC name of N-(5-oxopyrrolidin-3-yl)-1H-indazole-6-carboxamide (CID 114156980) is N-(5-oxopyrrolidin-3-yl)-1H-indazole-6-carboxamide.
What is the SMILES notation for N-(5-oxopyrrolidin-3-yl)-1H-indazole-6-carboxamide?
The canonical SMILES for N-(5-oxopyrrolidin-3-yl)-1H-indazole-6-carboxamide is O=C1CC(NC(=O)c2ccc3cn[nH]c3c2)CN1.
What is the InChIKey of N-(5-oxopyrrolidin-3-yl)-1H-indazole-6-carboxamide?
The InChIKey is KDRTZCOGGKOLKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N4O2/c17-11-4-9(6-13-11)15-12(18)7-1-2-8-5-14-16-10(8)3-7/h1-3,5,9H,4,6H2,(H,13,17)(H,14,16)(H,15,18).
What are the key properties of N-(5-oxopyrrolidin-3-yl)-1H-indazole-6-carboxamide?
N-(5-oxopyrrolidin-3-yl)-1H-indazole-6-carboxamide has a molecular weight of 244.25 g/mol, XLogP of 0.18, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-oxopyrrolidin-3-yl)-1H-indazole-6-carboxamide is sourced from PubChem (CID 114156980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).