3-amino-4-oxo-1H-indeno[2,1-d]pyrazole-5-carboxamide

C11H8N4O2 — CID 154449735

IUPAC3-amino-4-oxo-1H-indeno[2,1-d]pyrazole-5-carboxamide
SMILESNC(=O)c1cccc2c1C(=O)c1c(N)n[nH]c1-2
InChIInChI=1S/C11H8N4O2/c12-10-7-8(14-15-10)4-2-1-3-5(11(13)17)6(4)9(7)16/h1-3H,(H2,13,17)(H3,12,14,15)
InChIKeyADFXMACGHXWGHA-UHFFFAOYSA-N
MW228.21 g/mol
LogP0.30
Rot. Bonds1

About 3-amino-4-oxo-1H-indeno[2,1-d]pyrazole-5-carboxamide

3-amino-4-oxo-1H-indeno[2,1-d]pyrazole-5-carboxamide (PubChem CID 154449735) has the molecular formula C11H8N4O2 and a molecular weight of 228.21 g/mol. Its IUPAC name is 3-amino-4-oxo-1H-indeno[2,1-d]pyrazole-5-carboxamide.

Molecular Properties

Compound Name3-amino-4-oxo-1H-indeno[2,1-d]pyrazole-5-carboxamide
PubChem CID154449735
Molecular FormulaC11H8N4O2
Molecular Weight228.21 g/mol
Exact Mass228.06
IUPAC Name3-amino-4-oxo-1H-indeno[2,1-d]pyrazole-5-carboxamide
SMILESNC(=O)c1cccc2c1C(=O)c1c(N)n[nH]c1-2
InChIInChI=1S/C11H8N4O2/c12-10-7-8(14-15-10)4-2-1-3-5(11(13)17)6(4)9(7)16/h1-3H,(H2,13,17)(H3,12,14,15)
InChIKeyADFXMACGHXWGHA-UHFFFAOYSA-N
XLogP0.30
TPSA114.86 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.21
LogP ≤ 50.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-N',N'-dimethyl-4-oxo-1H-indeno[2,1-d]pyrazole-5-carbohydrazide
CID 54361052
4-oxo-3-pyridin-4-yl-1H-indeno[2,1-d]pyrazole-5-carboxamide
CID 141064167
3-amino-N-morpholin-4-yl-4-oxo-1H-indeno[2,1-d]pyrazole-5-carboxamide
CID 54260593
2-amino-3-[2-(2-amino-3-carbamoylphenyl)phenyl]benzamide
CID 54284404
8-amino-9,10-dioxoanthracene-1-carboxylic acid
CID 10683232
8-(2H-triazol-4-yl)naphthalene-1-carboxamide
CID 21338713
3-pyridin-2-yl-2-thiophen-3-ylbenzamide
CID 67699293
N-(4-oxo-3-pyridin-4-yl-1H-indeno[2,1-d]pyrazol-5-yl)acetamide
CID 5329642
6-amino-3-(2,5-dimethylthiophen-3-yl)-4-oxo-1H-indeno[2,1-d]pyrazole-5-carboxamide
CID 154057779
3-(1H-pyrazolo[4,5-b]pyridin-5-yl)-2-pyridin-3-ylbenzamide
CID 126536045
4-oxo-3H-1,2,3-benzotriazine-8-carboxamide
CID 135518053
2-amino-1H-benzimidazole-4-carboxamide
CID 10442222

Frequently Asked Questions

What is the IUPAC name of 3-amino-4-oxo-1H-indeno[2,1-d]pyrazole-5-carboxamide?
The IUPAC name of 3-amino-4-oxo-1H-indeno[2,1-d]pyrazole-5-carboxamide (CID 154449735) is 3-amino-4-oxo-1H-indeno[2,1-d]pyrazole-5-carboxamide.
What is the SMILES notation for 3-amino-4-oxo-1H-indeno[2,1-d]pyrazole-5-carboxamide?
The canonical SMILES for 3-amino-4-oxo-1H-indeno[2,1-d]pyrazole-5-carboxamide is NC(=O)c1cccc2c1C(=O)c1c(N)n[nH]c1-2.
What is the InChIKey of 3-amino-4-oxo-1H-indeno[2,1-d]pyrazole-5-carboxamide?
The InChIKey is ADFXMACGHXWGHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8N4O2/c12-10-7-8(14-15-10)4-2-1-3-5(11(13)17)6(4)9(7)16/h1-3H,(H2,13,17)(H3,12,14,15).
What are the key properties of 3-amino-4-oxo-1H-indeno[2,1-d]pyrazole-5-carboxamide?
3-amino-4-oxo-1H-indeno[2,1-d]pyrazole-5-carboxamide has a molecular weight of 228.21 g/mol, XLogP of 0.30, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-4-oxo-1H-indeno[2,1-d]pyrazole-5-carboxamide is sourced from PubChem (CID 154449735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).