7-chloro-N-(pyridin-2-ylmethyl)quinazolin-4-amine

C14H11ClN4 — CID 1490545

IUPAC7-chloro-N-(pyridin-2-ylmethyl)quinazolin-4-amine
SMILESClc1ccc2c(NCc3ccccn3)ncnc2c1
InChIInChI=1S/C14H11ClN4/c15-10-4-5-12-13(7-10)18-9-19-14(12)17-8-11-3-1-2-6-16-11/h1-7,9H,8H2,(H,17,18,19)
InChIKeyZBSJOWIROBLROO-UHFFFAOYSA-N
MW270.72 g/mol
LogP3.29
Rot. Bonds3

About 7-chloro-N-(pyridin-2-ylmethyl)quinazolin-4-amine

7-chloro-N-(pyridin-2-ylmethyl)quinazolin-4-amine (PubChem CID 1490545) has the molecular formula C14H11ClN4 and a molecular weight of 270.72 g/mol. Its IUPAC name is 7-chloro-N-(pyridin-2-ylmethyl)quinazolin-4-amine.

Molecular Properties

Compound Name7-chloro-N-(pyridin-2-ylmethyl)quinazolin-4-amine
PubChem CID1490545
Molecular FormulaC14H11ClN4
Molecular Weight270.72 g/mol
Exact Mass270.07
IUPAC Name7-chloro-N-(pyridin-2-ylmethyl)quinazolin-4-amine
SMILESClc1ccc2c(NCc3ccccn3)ncnc2c1
InChIInChI=1S/C14H11ClN4/c15-10-4-5-12-13(7-10)18-9-19-14(12)17-8-11-3-1-2-6-16-11/h1-7,9H,8H2,(H,17,18,19)
InChIKeyZBSJOWIROBLROO-UHFFFAOYSA-N
XLogP3.29
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.72
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-chloro-N-(pyridin-2-ylmethyl)quinazolin-4-amine?
The IUPAC name of 7-chloro-N-(pyridin-2-ylmethyl)quinazolin-4-amine (CID 1490545) is 7-chloro-N-(pyridin-2-ylmethyl)quinazolin-4-amine.
What is the SMILES notation for 7-chloro-N-(pyridin-2-ylmethyl)quinazolin-4-amine?
The canonical SMILES for 7-chloro-N-(pyridin-2-ylmethyl)quinazolin-4-amine is Clc1ccc2c(NCc3ccccn3)ncnc2c1.
What is the InChIKey of 7-chloro-N-(pyridin-2-ylmethyl)quinazolin-4-amine?
The InChIKey is ZBSJOWIROBLROO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClN4/c15-10-4-5-12-13(7-10)18-9-19-14(12)17-8-11-3-1-2-6-16-11/h1-7,9H,8H2,(H,17,18,19).
What are the key properties of 7-chloro-N-(pyridin-2-ylmethyl)quinazolin-4-amine?
7-chloro-N-(pyridin-2-ylmethyl)quinazolin-4-amine has a molecular weight of 270.72 g/mol, XLogP of 3.29, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-N-(pyridin-2-ylmethyl)quinazolin-4-amine is sourced from PubChem (CID 1490545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).