3-phenyl-4H-quinazoline;hydrochloride

C14H13ClN2 — CID 15945624

IUPAC3-phenyl-4H-quinazoline;hydrochloride
SMILESC1=Nc2ccccc2CN1c1ccccc1.Cl
InChIInChI=1S/C14H12N2.ClH/c1-2-7-13(8-3-1)16-10-12-6-4-5-9-14(12)15-11-16;/h1-9,11H,10H2;1H
InChIKeySSYYHLNEVQGLNV-UHFFFAOYSA-N
MW244.73 g/mol
LogP3.79
Rot. Bonds1

About 3-phenyl-4H-quinazoline;hydrochloride

3-phenyl-4H-quinazoline;hydrochloride (PubChem CID 15945624) has the molecular formula C14H13ClN2 and a molecular weight of 244.73 g/mol. Its IUPAC name is 3-phenyl-4H-quinazoline;hydrochloride.

Molecular Properties

Compound Name3-phenyl-4H-quinazoline;hydrochloride
PubChem CID15945624
Molecular FormulaC14H13ClN2
Molecular Weight244.73 g/mol
Exact Mass244.08
IUPAC Name3-phenyl-4H-quinazoline;hydrochloride
SMILESC1=Nc2ccccc2CN1c1ccccc1.Cl
InChIInChI=1S/C14H12N2.ClH/c1-2-7-13(8-3-1)16-10-12-6-4-5-9-14(12)15-11-16;/h1-9,11H,10H2;1H
InChIKeySSYYHLNEVQGLNV-UHFFFAOYSA-N
XLogP3.79
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.73
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Deoxypeganine
CID 442894
1H,2H,3H,9H-pyrrolo[2,1-b]quinazoline hydrochloride
CID 3046290
1,2-Dimethyl-1H-perimidine
CID 215090
Perimidine, 1-methyl-
CID 209253
1,4-Dihydro-quinazolin-2-ylamine monohydrobromide
CID 45263885
3,4-Dihydro-6-(isopropyl)-3-(4-(isopropyl)phenyl)quinazoline
CID 99600
1-Prop-2-enylperimidine
CID 745096
1-Ethyl-1H-perimidine
CID 750289
1(2H)-Quinolinecarboximidamide, 3,4-dihydro-2-methyl-N-phenyl-, monohydrochloride
CID 3052007
6-Methyl-3-(p-tolyl)-3,4-dihydroquinazoline
CID 224464
3,4-dihydro-2(1H)-quinolinylidene(phenyl)amine
CID 780385
5-Phenyl-2,3-dihydroimidazo[1,2-c]quinazoline
CID 15620519

Frequently Asked Questions

What is the IUPAC name of 3-phenyl-4H-quinazoline;hydrochloride?
The IUPAC name of 3-phenyl-4H-quinazoline;hydrochloride (CID 15945624) is 3-phenyl-4H-quinazoline;hydrochloride.
What is the SMILES notation for 3-phenyl-4H-quinazoline;hydrochloride?
The canonical SMILES for 3-phenyl-4H-quinazoline;hydrochloride is C1=Nc2ccccc2CN1c1ccccc1.Cl.
What is the InChIKey of 3-phenyl-4H-quinazoline;hydrochloride?
The InChIKey is SSYYHLNEVQGLNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2.ClH/c1-2-7-13(8-3-1)16-10-12-6-4-5-9-14(12)15-11-16;/h1-9,11H,10H2;1H.
What are the key properties of 3-phenyl-4H-quinazoline;hydrochloride?
3-phenyl-4H-quinazoline;hydrochloride has a molecular weight of 244.73 g/mol, XLogP of 3.79, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-4H-quinazoline;hydrochloride is sourced from PubChem (CID 15945624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).