(8-hydroxy-4-methylquinazolin-2-yl)cyanamide

C10H8N4O — CID 170701789

IUPAC(8-hydroxy-4-methylquinazolin-2-yl)cyanamide
SMILESCc1nc(NC#N)nc2c(O)cccc12
InChIInChI=1S/C10H8N4O/c1-6-7-3-2-4-8(15)9(7)14-10(13-6)12-5-11/h2-4,15H,1H3,(H,12,13,14)
InChIKeyAFCRDOBMFKAGAG-UHFFFAOYSA-N
MW200.20 g/mol
LogP1.54
Rot. Bonds1

About (8-hydroxy-4-methylquinazolin-2-yl)cyanamide

(8-hydroxy-4-methylquinazolin-2-yl)cyanamide (PubChem CID 170701789) has the molecular formula C10H8N4O and a molecular weight of 200.20 g/mol. Its IUPAC name is (8-hydroxy-4-methylquinazolin-2-yl)cyanamide.

Molecular Properties

Compound Name(8-hydroxy-4-methylquinazolin-2-yl)cyanamide
PubChem CID170701789
Molecular FormulaC10H8N4O
Molecular Weight200.20 g/mol
Exact Mass200.07
IUPAC Name(8-hydroxy-4-methylquinazolin-2-yl)cyanamide
SMILESCc1nc(NC#N)nc2c(O)cccc12
InChIInChI=1S/C10H8N4O/c1-6-7-3-2-4-8(15)9(7)14-10(13-6)12-5-11/h2-4,15H,1H3,(H,12,13,14)
InChIKeyAFCRDOBMFKAGAG-UHFFFAOYSA-N
XLogP1.54
TPSA81.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.20
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'cyanate_/aminonitrile_/thiocyanate', 'substructure': 'N/A'}, {'alert_name': 'enamine', 'substructure': 'N/A'}

Analyze (8-hydroxy-4-methylquinazolin-2-yl)cyanamide 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

3,4-dibromo-2-methylquinolin-8-ol
CID 149162585
[4-(2-hydroxyphenyl)-6-[(E)-2-(4-methylsulfanylphenyl)ethenyl]-1,3,5-triazin-2-yl]cyanamide
CID 135842913
CID 66916636
CID 66916636
4-methyl-2-N-(methylideneamino)-8-N-propan-2-ylquinazoline-2,8-diamine
CID 166645412
4-methoxy-2-methylquinolin-8-ol
CID 18321891
2-methyl-4-(propylamino)quinolin-8-ol
CID 45097479
CID 172780914
CID 172780914
2,4-dibromoquinazolin-8-ol
CID 175262476
methane;2,4,8-trimethylquinazoline
CID 159057761
8-fluoro-2-methylquinoline-4-carbonitrile
CID 82448796
CID 69253745
CID 69253745
bis(2,4-dimethylquinolin-8-ol);2-hydroxy-6-phenylbenzaldehyde
CID 87699606

Frequently Asked Questions

What is the IUPAC name of (8-hydroxy-4-methylquinazolin-2-yl)cyanamide?
The IUPAC name of (8-hydroxy-4-methylquinazolin-2-yl)cyanamide (CID 170701789) is (8-hydroxy-4-methylquinazolin-2-yl)cyanamide.
What is the SMILES notation for (8-hydroxy-4-methylquinazolin-2-yl)cyanamide?
The canonical SMILES for (8-hydroxy-4-methylquinazolin-2-yl)cyanamide is Cc1nc(NC#N)nc2c(O)cccc12.
What is the InChIKey of (8-hydroxy-4-methylquinazolin-2-yl)cyanamide?
The InChIKey is AFCRDOBMFKAGAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N4O/c1-6-7-3-2-4-8(15)9(7)14-10(13-6)12-5-11/h2-4,15H,1H3,(H,12,13,14).
What are the key properties of (8-hydroxy-4-methylquinazolin-2-yl)cyanamide?
(8-hydroxy-4-methylquinazolin-2-yl)cyanamide has a molecular weight of 200.20 g/mol, XLogP of 1.54, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (8-hydroxy-4-methylquinazolin-2-yl)cyanamide is sourced from PubChem (CID 170701789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).