3-[(2-hydrazinylquinazolin-4-yl)amino]-2-hydroxypropanamide

C11H14N6O2 — CID 114154625

IUPAC3-[(2-hydrazinylquinazolin-4-yl)amino]-2-hydroxypropanamide
SMILESNNc1nc(NCC(O)C(N)=O)c2ccccc2n1
InChIInChI=1S/C11H14N6O2/c12-9(19)8(18)5-14-10-6-3-1-2-4-7(6)15-11(16-10)17-13/h1-4,8,18H,5,13H2,(H2,12,19)(H2,14,15,16,17)
InChIKeyPYCBSTHBAHQUMM-UHFFFAOYSA-N
MW262.27 g/mol
LogP-0.83
Rot. Bonds5

About 3-[(2-hydrazinylquinazolin-4-yl)amino]-2-hydroxypropanamide

3-[(2-hydrazinylquinazolin-4-yl)amino]-2-hydroxypropanamide (PubChem CID 114154625) has the molecular formula C11H14N6O2 and a molecular weight of 262.27 g/mol. Its IUPAC name is 3-[(2-hydrazinylquinazolin-4-yl)amino]-2-hydroxypropanamide.

Molecular Properties

Compound Name3-[(2-hydrazinylquinazolin-4-yl)amino]-2-hydroxypropanamide
PubChem CID114154625
Molecular FormulaC11H14N6O2
Molecular Weight262.27 g/mol
Exact Mass262.12
IUPAC Name3-[(2-hydrazinylquinazolin-4-yl)amino]-2-hydroxypropanamide
SMILESNNc1nc(NCC(O)C(N)=O)c2ccccc2n1
InChIInChI=1S/C11H14N6O2/c12-9(19)8(18)5-14-10-6-3-1-2-4-7(6)15-11(16-10)17-13/h1-4,8,18H,5,13H2,(H2,12,19)(H2,14,15,16,17)
InChIKeyPYCBSTHBAHQUMM-UHFFFAOYSA-N
XLogP-0.83
TPSA139.18 Ų
H-Bond Donors5
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.27
LogP ≤ 5-0.83
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

4-[(2-hydrazinylquinazolin-4-yl)amino]-3-methylbutan-1-ol
CID 80922127
N-(2,3-dimethylbutyl)-2-hydrazinylquinazolin-4-amine
CID 80917863
2-hydrazinyl-N-(3-methyl-2-propan-2-ylbutyl)quinazolin-4-amine
CID 102908996
4-[(2-hydrazinylquinazolin-4-yl)amino]butan-1-ol
CID 106847076
3-[(3-aminoquinoxalin-2-yl)amino]-2-hydroxypropanamide
CID 106174445
3-(cinnolin-4-ylamino)-2-hydroxypropanamide
CID 114153484
3-[(5-bromo-2-hydrazinylpyrimidin-4-yl)amino]-2-hydroxypropanamide
CID 106179503
N-(2-ethylhexyl)-2-hydrazinylquinazolin-4-amine
CID 107819198
1-(dimethylamino)-3-[(2-hydrazinylquinazolin-4-yl)amino]-2-methylpropan-2-ol
CID 106150386
N-[(4-bromophenyl)methyl]-2-hydrazinylquinazolin-4-amine
CID 80912063
2-[(2-hydrazinylquinazolin-4-yl)amino]-N-propylpropanamide
CID 80901097
N-cyclopropyl-2-hydrazinylquinazolin-4-amine
CID 80932837

Frequently Asked Questions

What is the IUPAC name of 3-[(2-hydrazinylquinazolin-4-yl)amino]-2-hydroxypropanamide?
The IUPAC name of 3-[(2-hydrazinylquinazolin-4-yl)amino]-2-hydroxypropanamide (CID 114154625) is 3-[(2-hydrazinylquinazolin-4-yl)amino]-2-hydroxypropanamide.
What is the SMILES notation for 3-[(2-hydrazinylquinazolin-4-yl)amino]-2-hydroxypropanamide?
The canonical SMILES for 3-[(2-hydrazinylquinazolin-4-yl)amino]-2-hydroxypropanamide is NNc1nc(NCC(O)C(N)=O)c2ccccc2n1.
What is the InChIKey of 3-[(2-hydrazinylquinazolin-4-yl)amino]-2-hydroxypropanamide?
The InChIKey is PYCBSTHBAHQUMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N6O2/c12-9(19)8(18)5-14-10-6-3-1-2-4-7(6)15-11(16-10)17-13/h1-4,8,18H,5,13H2,(H2,12,19)(H2,14,15,16,17).
What are the key properties of 3-[(2-hydrazinylquinazolin-4-yl)amino]-2-hydroxypropanamide?
3-[(2-hydrazinylquinazolin-4-yl)amino]-2-hydroxypropanamide has a molecular weight of 262.27 g/mol, XLogP of -0.83, 5 rotatable bonds, 5 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-hydrazinylquinazolin-4-yl)amino]-2-hydroxypropanamide is sourced from PubChem (CID 114154625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).