3-(cinnolin-4-ylamino)-2-hydroxypropanamide

C11H12N4O2 — CID 114153484

IUPAC3-(cinnolin-4-ylamino)-2-hydroxypropanamide
SMILESNC(=O)C(O)CNc1cnnc2ccccc12
InChIInChI=1S/C11H12N4O2/c12-11(17)10(16)6-13-9-5-14-15-8-4-2-1-3-7(8)9/h1-5,10,16H,6H2,(H2,12,17)(H,13,15)
InChIKeyKCHHJQLTPGXXNN-UHFFFAOYSA-N
MW232.24 g/mol
LogP-0.11
Rot. Bonds4

About 3-(cinnolin-4-ylamino)-2-hydroxypropanamide

3-(cinnolin-4-ylamino)-2-hydroxypropanamide (PubChem CID 114153484) has the molecular formula C11H12N4O2 and a molecular weight of 232.24 g/mol. Its IUPAC name is 3-(cinnolin-4-ylamino)-2-hydroxypropanamide.

Molecular Properties

Compound Name3-(cinnolin-4-ylamino)-2-hydroxypropanamide
PubChem CID114153484
Molecular FormulaC11H12N4O2
Molecular Weight232.24 g/mol
Exact Mass232.10
IUPAC Name3-(cinnolin-4-ylamino)-2-hydroxypropanamide
SMILESNC(=O)C(O)CNc1cnnc2ccccc12
InChIInChI=1S/C11H12N4O2/c12-11(17)10(16)6-13-9-5-14-15-8-4-2-1-3-7(8)9/h1-5,10,16H,6H2,(H2,12,17)(H,13,15)
InChIKeyKCHHJQLTPGXXNN-UHFFFAOYSA-N
XLogP-0.11
TPSA101.13 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.24
LogP ≤ 5-0.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 3-(cinnolin-4-ylamino)-2-hydroxypropanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(cinnolin-4-ylamino)methyl]butanoic acid
CID 65226536
1-(4-aminophenyl)-2-(cinnolin-4-ylamino)ethanol
CID 63586762
2-(cinnolin-4-ylamino)-1-cyclopropylethanol
CID 63586399
3-[(2-hydrazinylquinazolin-4-yl)amino]-2-hydroxypropanamide
CID 114154625
4-(cinnolin-4-ylamino)-2-methylbutanoic acid
CID 80539553
methyl 3-(cinnolin-4-ylamino)propanoate
CID 63588842
3-(cinnolin-4-ylamino)butan-1-ol
CID 83187349
4-[(cinnolin-4-ylamino)methyl]benzoic acid
CID 63587099
cinnolin-4-ylhydrazine
CID 39733519
N-[(1-aminocyclobutyl)methyl]cinnolin-4-amine
CID 103353871
N-(2,2,2-trifluoroethyl)cinnolin-4-amine
CID 63586208
3-[(3-aminoquinoxalin-2-yl)amino]-2-hydroxypropanamide
CID 106174445

Frequently Asked Questions

What is the IUPAC name of 3-(cinnolin-4-ylamino)-2-hydroxypropanamide?
The IUPAC name of 3-(cinnolin-4-ylamino)-2-hydroxypropanamide (CID 114153484) is 3-(cinnolin-4-ylamino)-2-hydroxypropanamide.
What is the SMILES notation for 3-(cinnolin-4-ylamino)-2-hydroxypropanamide?
The canonical SMILES for 3-(cinnolin-4-ylamino)-2-hydroxypropanamide is NC(=O)C(O)CNc1cnnc2ccccc12.
What is the InChIKey of 3-(cinnolin-4-ylamino)-2-hydroxypropanamide?
The InChIKey is KCHHJQLTPGXXNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O2/c12-11(17)10(16)6-13-9-5-14-15-8-4-2-1-3-7(8)9/h1-5,10,16H,6H2,(H2,12,17)(H,13,15).
What are the key properties of 3-(cinnolin-4-ylamino)-2-hydroxypropanamide?
3-(cinnolin-4-ylamino)-2-hydroxypropanamide has a molecular weight of 232.24 g/mol, XLogP of -0.11, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cinnolin-4-ylamino)-2-hydroxypropanamide is sourced from PubChem (CID 114153484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).