1-(7-fluoroquinazolin-2-yl)ethanamine

C10H10FN3 — CID 105444819

IUPAC1-(7-fluoroquinazolin-2-yl)ethanamine
SMILESCC(N)c1ncc2ccc(F)cc2n1
InChIInChI=1S/C10H10FN3/c1-6(12)10-13-5-7-2-3-8(11)4-9(7)14-10/h2-6H,12H2,1H3
InChIKeyAZQPNCPNGOHCLW-UHFFFAOYSA-N
MW191.21 g/mol
LogP1.79
Rot. Bonds1

About 1-(7-fluoroquinazolin-2-yl)ethanamine

1-(7-fluoroquinazolin-2-yl)ethanamine (PubChem CID 105444819) has the molecular formula C10H10FN3 and a molecular weight of 191.21 g/mol. Its IUPAC name is 1-(7-fluoroquinazolin-2-yl)ethanamine.

Molecular Properties

Compound Name1-(7-fluoroquinazolin-2-yl)ethanamine
PubChem CID105444819
Molecular FormulaC10H10FN3
Molecular Weight191.21 g/mol
Exact Mass191.09
IUPAC Name1-(7-fluoroquinazolin-2-yl)ethanamine
SMILESCC(N)c1ncc2ccc(F)cc2n1
InChIInChI=1S/C10H10FN3/c1-6(12)10-13-5-7-2-3-8(11)4-9(7)14-10/h2-6H,12H2,1H3
InChIKeyAZQPNCPNGOHCLW-UHFFFAOYSA-N
XLogP1.79
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.21
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(7-fluoroquinazolin-2-yl)ethanamine?
The IUPAC name of 1-(7-fluoroquinazolin-2-yl)ethanamine (CID 105444819) is 1-(7-fluoroquinazolin-2-yl)ethanamine.
What is the SMILES notation for 1-(7-fluoroquinazolin-2-yl)ethanamine?
The canonical SMILES for 1-(7-fluoroquinazolin-2-yl)ethanamine is CC(N)c1ncc2ccc(F)cc2n1.
What is the InChIKey of 1-(7-fluoroquinazolin-2-yl)ethanamine?
The InChIKey is AZQPNCPNGOHCLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FN3/c1-6(12)10-13-5-7-2-3-8(11)4-9(7)14-10/h2-6H,12H2,1H3.
What are the key properties of 1-(7-fluoroquinazolin-2-yl)ethanamine?
1-(7-fluoroquinazolin-2-yl)ethanamine has a molecular weight of 191.21 g/mol, XLogP of 1.79, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-fluoroquinazolin-2-yl)ethanamine is sourced from PubChem (CID 105444819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).