2-(2-fluorophenyl)-4-piperidin-1-ylquinazoline

C19H18FN3 — CID 661467

IUPAC2-(2-fluorophenyl)-4-piperidin-1-ylquinazoline
SMILESFc1ccccc1-c1nc(N2CCCCC2)c2ccccc2n1
InChIInChI=1S/C19H18FN3/c20-16-10-4-2-8-14(16)18-21-17-11-5-3-9-15(17)19(22-18)23-12-6-1-7-13-23/h2-5,8-11H,1,6-7,12-13H2
InChIKeyCFTJZAHIDNOCFU-UHFFFAOYSA-N
MW307.37 g/mol
LogP4.43
Rot. Bonds2

About 2-(2-fluorophenyl)-4-piperidin-1-ylquinazoline

2-(2-fluorophenyl)-4-piperidin-1-ylquinazoline (PubChem CID 661467) has the molecular formula C19H18FN3 and a molecular weight of 307.37 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-4-piperidin-1-ylquinazoline.

Molecular Properties

Compound Name2-(2-fluorophenyl)-4-piperidin-1-ylquinazoline
PubChem CID661467
Molecular FormulaC19H18FN3
Molecular Weight307.37 g/mol
Exact Mass307.15
IUPAC Name2-(2-fluorophenyl)-4-piperidin-1-ylquinazoline
SMILESFc1ccccc1-c1nc(N2CCCCC2)c2ccccc2n1
InChIInChI=1S/C19H18FN3/c20-16-10-4-2-8-14(16)18-21-17-11-5-3-9-15(17)19(22-18)23-12-6-1-7-13-23/h2-5,8-11H,1,6-7,12-13H2
InChIKeyCFTJZAHIDNOCFU-UHFFFAOYSA-N
XLogP4.43
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.37
LogP ≤ 54.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-4-piperidin-1-ylquinazoline?
The IUPAC name of 2-(2-fluorophenyl)-4-piperidin-1-ylquinazoline (CID 661467) is 2-(2-fluorophenyl)-4-piperidin-1-ylquinazoline.
What is the SMILES notation for 2-(2-fluorophenyl)-4-piperidin-1-ylquinazoline?
The canonical SMILES for 2-(2-fluorophenyl)-4-piperidin-1-ylquinazoline is Fc1ccccc1-c1nc(N2CCCCC2)c2ccccc2n1.
What is the InChIKey of 2-(2-fluorophenyl)-4-piperidin-1-ylquinazoline?
The InChIKey is CFTJZAHIDNOCFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18FN3/c20-16-10-4-2-8-14(16)18-21-17-11-5-3-9-15(17)19(22-18)23-12-6-1-7-13-23/h2-5,8-11H,1,6-7,12-13H2.
What are the key properties of 2-(2-fluorophenyl)-4-piperidin-1-ylquinazoline?
2-(2-fluorophenyl)-4-piperidin-1-ylquinazoline has a molecular weight of 307.37 g/mol, XLogP of 4.43, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-4-piperidin-1-ylquinazoline is sourced from PubChem (CID 661467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).