6-fluoro-2-methyl-3-pyridin-3-ylquinazolin-4-one

C14H10FN3O — CID 134445912

IUPAC6-fluoro-2-methyl-3-pyridin-3-ylquinazolin-4-one
SMILESCc1nc2ccc(F)cc2c(=O)n1-c1cccnc1
InChIInChI=1S/C14H10FN3O/c1-9-17-13-5-4-10(15)7-12(13)14(19)18(9)11-3-2-6-16-8-11/h2-8H,1H3
InChIKeyKWVRVPYDUIVKIJ-UHFFFAOYSA-N
MW255.25 g/mol
LogP2.23
Rot. Bonds1

About 6-fluoro-2-methyl-3-pyridin-3-ylquinazolin-4-one

6-fluoro-2-methyl-3-pyridin-3-ylquinazolin-4-one (PubChem CID 134445912) has the molecular formula C14H10FN3O and a molecular weight of 255.25 g/mol. Its IUPAC name is 6-fluoro-2-methyl-3-pyridin-3-ylquinazolin-4-one.

Molecular Properties

Compound Name6-fluoro-2-methyl-3-pyridin-3-ylquinazolin-4-one
PubChem CID134445912
Molecular FormulaC14H10FN3O
Molecular Weight255.25 g/mol
Exact Mass255.08
IUPAC Name6-fluoro-2-methyl-3-pyridin-3-ylquinazolin-4-one
SMILESCc1nc2ccc(F)cc2c(=O)n1-c1cccnc1
InChIInChI=1S/C14H10FN3O/c1-9-17-13-5-4-10(15)7-12(13)14(19)18(9)11-3-2-6-16-8-11/h2-8H,1H3
InChIKeyKWVRVPYDUIVKIJ-UHFFFAOYSA-N
XLogP2.23
TPSA47.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.25
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5,11-Dihydro-6H-pyrido(2,3-b)(1,4)benzodiazepin-6-one
CID 70169
3-phenyl-2-[(E)-2-pyridin-2-ylethenyl]quinazolin-4-one
CID 5742213
Src-820 R
CID 63120
3-(2-methylphenyl)-2-(2-(2-pyridinyl)ethenyl)-4(3H)-quinazolinone
CID 63114
((E)-3-benzyl-2-(2-(pyridin-3-yl)vinyl)quinazolin-4-(3H)-one)
CID 5738263
2-(Pyridin-4-yl)quinazolin-4-ol
CID 135412668
N11-Ethyl-N5-methyl-5,11-dihydro-6H-pyrido(2,3-b)(1,4)benzodiazepin-6-one
CID 453351
N5,N11-Diethyl-5,11-dihydro-6H-pyrido(2,3-b)(1,4)benzodiazepin-6-one
CID 453352
8,N5-Dimethyl-N11-ethyl-5,11-dihydro-6H-pyrido(2,3-b)(1,4)benzodiazepin-6-one
CID 453353
N5,N11-Diethyl-10-methyl-5,11-dihydro-6H-pyrido(2,3-b)(1,4)benzodiazepin-6-one
CID 453354
2-Ethyl-13-[2-(3-fluorophenyl)ethyl]-9-methyl-2,4,9,15-tetraazatricyclo[9.4.0.0^{3,8}]pentadeca-1(15),3(8),4,6,11,13-hexaen-10-one
CID 470738
3-(4-Oxo-3,4-Dihydroquinazolin-2-Yl)-N-[(1r)-1-(Pyridin-2-Yl)ethyl]propanamide
CID 135566762

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-2-methyl-3-pyridin-3-ylquinazolin-4-one?
The IUPAC name of 6-fluoro-2-methyl-3-pyridin-3-ylquinazolin-4-one (CID 134445912) is 6-fluoro-2-methyl-3-pyridin-3-ylquinazolin-4-one.
What is the SMILES notation for 6-fluoro-2-methyl-3-pyridin-3-ylquinazolin-4-one?
The canonical SMILES for 6-fluoro-2-methyl-3-pyridin-3-ylquinazolin-4-one is Cc1nc2ccc(F)cc2c(=O)n1-c1cccnc1.
What is the InChIKey of 6-fluoro-2-methyl-3-pyridin-3-ylquinazolin-4-one?
The InChIKey is KWVRVPYDUIVKIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10FN3O/c1-9-17-13-5-4-10(15)7-12(13)14(19)18(9)11-3-2-6-16-8-11/h2-8H,1H3.
What are the key properties of 6-fluoro-2-methyl-3-pyridin-3-ylquinazolin-4-one?
6-fluoro-2-methyl-3-pyridin-3-ylquinazolin-4-one has a molecular weight of 255.25 g/mol, XLogP of 2.23, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-2-methyl-3-pyridin-3-ylquinazolin-4-one is sourced from PubChem (CID 134445912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).