N-ethyl-4-pyridin-2-ylsulfanylquinazolin-2-amine

C15H14N4S — CID 80883177

IUPACN-ethyl-4-pyridin-2-ylsulfanylquinazolin-2-amine
SMILESCCNc1nc(Sc2ccccn2)c2ccccc2n1
InChIInChI=1S/C15H14N4S/c1-2-16-15-18-12-8-4-3-7-11(12)14(19-15)20-13-9-5-6-10-17-13/h3-10H,2H2,1H3,(H,16,18,19)
InChIKeyQKBXMSLBOOKSEN-UHFFFAOYSA-N
MW282.37 g/mol
LogP3.61
Rot. Bonds4

About N-ethyl-4-pyridin-2-ylsulfanylquinazolin-2-amine

N-ethyl-4-pyridin-2-ylsulfanylquinazolin-2-amine (PubChem CID 80883177) has the molecular formula C15H14N4S and a molecular weight of 282.37 g/mol. Its IUPAC name is N-ethyl-4-pyridin-2-ylsulfanylquinazolin-2-amine.

Molecular Properties

Compound NameN-ethyl-4-pyridin-2-ylsulfanylquinazolin-2-amine
PubChem CID80883177
Molecular FormulaC15H14N4S
Molecular Weight282.37 g/mol
Exact Mass282.09
IUPAC NameN-ethyl-4-pyridin-2-ylsulfanylquinazolin-2-amine
SMILESCCNc1nc(Sc2ccccn2)c2ccccc2n1
InChIInChI=1S/C15H14N4S/c1-2-16-15-18-12-8-4-3-7-11(12)14(19-15)20-13-9-5-6-10-17-13/h3-10H,2H2,1H3,(H,16,18,19)
InChIKeyQKBXMSLBOOKSEN-UHFFFAOYSA-N
XLogP3.61
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.37
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-ethyl-4-pyridin-2-ylsulfanylquinazolin-2-amine 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

N-ethyl-4-(1H-imidazol-2-ylsulfanyl)quinazolin-2-amine
CID 107784957
5-bromo-N-ethyl-4-pyridin-2-ylsulfanylpyrimidin-2-amine
CID 80882339
N-ethyl-4-(4-fluorophenyl)sulfanylquinazolin-2-amine
CID 80869962
N-ethyl-4-(2-fluorophenyl)sulfanylquinazolin-2-amine
CID 80873489
N-ethyl-4-pyridin-2-ylsulfanylpyrimidin-2-amine
CID 80882665
N-ethyl-4-(1-methyltetrazol-5-yl)sulfanylquinazolin-2-amine
CID 80887083
4-(2,5-dimethylpyrazol-3-yl)sulfanyl-N-ethylquinazolin-2-amine
CID 80887617
3-[2-(ethylamino)quinazolin-4-yl]sulfanyl-4-methyl-1H-1,2,4-triazol-5-one
CID 80882976
(4-pyrimidin-2-ylsulfanylquinazolin-2-yl)hydrazine
CID 80924768
N-propyl-4-(1H-1,2,4-triazol-5-ylsulfanyl)quinazolin-2-amine
CID 80885003
N-ethyl-4-propoxyquinazolin-2-amine
CID 80867291
2-cyclopropyl-N-ethyl-5-methyl-6-pyridin-2-ylsulfanylpyrimidin-4-amine
CID 80990645

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-pyridin-2-ylsulfanylquinazolin-2-amine?
The IUPAC name of N-ethyl-4-pyridin-2-ylsulfanylquinazolin-2-amine (CID 80883177) is N-ethyl-4-pyridin-2-ylsulfanylquinazolin-2-amine.
What is the SMILES notation for N-ethyl-4-pyridin-2-ylsulfanylquinazolin-2-amine?
The canonical SMILES for N-ethyl-4-pyridin-2-ylsulfanylquinazolin-2-amine is CCNc1nc(Sc2ccccn2)c2ccccc2n1.
What is the InChIKey of N-ethyl-4-pyridin-2-ylsulfanylquinazolin-2-amine?
The InChIKey is QKBXMSLBOOKSEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4S/c1-2-16-15-18-12-8-4-3-7-11(12)14(19-15)20-13-9-5-6-10-17-13/h3-10H,2H2,1H3,(H,16,18,19).
What are the key properties of N-ethyl-4-pyridin-2-ylsulfanylquinazolin-2-amine?
N-ethyl-4-pyridin-2-ylsulfanylquinazolin-2-amine has a molecular weight of 282.37 g/mol, XLogP of 3.61, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-pyridin-2-ylsulfanylquinazolin-2-amine is sourced from PubChem (CID 80883177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).