3-fluoro-11H-pyrido[2,1-b]quinazoline

C12H9FN2 — CID 18992220

IUPAC3-fluoro-11H-pyrido[2,1-b]quinazoline
SMILESFc1ccc2c(c1)N=C1C=CC=CN1C2
InChIInChI=1S/C12H9FN2/c13-10-5-4-9-8-15-6-2-1-3-12(15)14-11(9)7-10/h1-7H,8H2
InChIKeyYZHNFKMKAPADPW-UHFFFAOYSA-N
MW200.22 g/mol
LogP2.75
Rot. Bonds

About 3-fluoro-11H-pyrido[2,1-b]quinazoline

3-fluoro-11H-pyrido[2,1-b]quinazoline (PubChem CID 18992220) has the molecular formula C12H9FN2 and a molecular weight of 200.22 g/mol. Its IUPAC name is 3-fluoro-11H-pyrido[2,1-b]quinazoline.

Molecular Properties

Compound Name3-fluoro-11H-pyrido[2,1-b]quinazoline
PubChem CID18992220
Molecular FormulaC12H9FN2
Molecular Weight200.22 g/mol
Exact Mass200.07
IUPAC Name3-fluoro-11H-pyrido[2,1-b]quinazoline
SMILESFc1ccc2c(c1)N=C1C=CC=CN1C2
InChIInChI=1S/C12H9FN2/c13-10-5-4-9-8-15-6-2-1-3-12(15)14-11(9)7-10/h1-7H,8H2
InChIKeyYZHNFKMKAPADPW-UHFFFAOYSA-N
XLogP2.75
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.22
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-11H-pyrido[2,1-b]quinazoline?
The IUPAC name of 3-fluoro-11H-pyrido[2,1-b]quinazoline (CID 18992220) is 3-fluoro-11H-pyrido[2,1-b]quinazoline.
What is the SMILES notation for 3-fluoro-11H-pyrido[2,1-b]quinazoline?
The canonical SMILES for 3-fluoro-11H-pyrido[2,1-b]quinazoline is Fc1ccc2c(c1)N=C1C=CC=CN1C2.
What is the InChIKey of 3-fluoro-11H-pyrido[2,1-b]quinazoline?
The InChIKey is YZHNFKMKAPADPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9FN2/c13-10-5-4-9-8-15-6-2-1-3-12(15)14-11(9)7-10/h1-7H,8H2.
What are the key properties of 3-fluoro-11H-pyrido[2,1-b]quinazoline?
3-fluoro-11H-pyrido[2,1-b]quinazoline has a molecular weight of 200.22 g/mol, XLogP of 2.75, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-11H-pyrido[2,1-b]quinazoline is sourced from PubChem (CID 18992220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).