N-ethyl-2-(2-phenylethenyl)quinazolin-4-amine

C18H17N3 — CID 58017075

IUPACN-ethyl-2-(2-phenylethenyl)quinazolin-4-amine
SMILESCCNc1nc(C=Cc2ccccc2)nc2ccccc12
InChIInChI=1S/C18H17N3/c1-2-19-18-15-10-6-7-11-16(15)20-17(21-18)13-12-14-8-4-3-5-9-14/h3-13H,2H2,1H3,(H,19,20,21)
InChIKeyLPZVHEPKCNUGDN-UHFFFAOYSA-N
MW275.36 g/mol
LogP4.23
Rot. Bonds4

About N-ethyl-2-(2-phenylethenyl)quinazolin-4-amine

N-ethyl-2-(2-phenylethenyl)quinazolin-4-amine (PubChem CID 58017075) has the molecular formula C18H17N3 and a molecular weight of 275.36 g/mol. Its IUPAC name is N-ethyl-2-(2-phenylethenyl)quinazolin-4-amine.

Molecular Properties

Compound NameN-ethyl-2-(2-phenylethenyl)quinazolin-4-amine
PubChem CID58017075
Molecular FormulaC18H17N3
Molecular Weight275.36 g/mol
Exact Mass275.14
IUPAC NameN-ethyl-2-(2-phenylethenyl)quinazolin-4-amine
SMILESCCNc1nc(C=Cc2ccccc2)nc2ccccc12
InChIInChI=1S/C18H17N3/c1-2-19-18-15-10-6-7-11-16(15)20-17(21-18)13-12-14-8-4-3-5-9-14/h3-13H,2H2,1H3,(H,19,20,21)
InChIKeyLPZVHEPKCNUGDN-UHFFFAOYSA-N
XLogP4.23
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-ethyl-2-(2-phenylethenyl)quinazolin-4-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(2-phenylethenyl)quinazolin-4-amine?
The IUPAC name of N-ethyl-2-(2-phenylethenyl)quinazolin-4-amine (CID 58017075) is N-ethyl-2-(2-phenylethenyl)quinazolin-4-amine.
What is the SMILES notation for N-ethyl-2-(2-phenylethenyl)quinazolin-4-amine?
The canonical SMILES for N-ethyl-2-(2-phenylethenyl)quinazolin-4-amine is CCNc1nc(C=Cc2ccccc2)nc2ccccc12.
What is the InChIKey of N-ethyl-2-(2-phenylethenyl)quinazolin-4-amine?
The InChIKey is LPZVHEPKCNUGDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3/c1-2-19-18-15-10-6-7-11-16(15)20-17(21-18)13-12-14-8-4-3-5-9-14/h3-13H,2H2,1H3,(H,19,20,21).
What are the key properties of N-ethyl-2-(2-phenylethenyl)quinazolin-4-amine?
N-ethyl-2-(2-phenylethenyl)quinazolin-4-amine has a molecular weight of 275.36 g/mol, XLogP of 4.23, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(2-phenylethenyl)quinazolin-4-amine is sourced from PubChem (CID 58017075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).