7-chloro-2-cyclopropylquinazoline

C11H9ClN2 — CID 172741252

IUPAC7-chloro-2-cyclopropylquinazoline
SMILESClc1ccc2cnc(C3CC3)nc2c1
InChIInChI=1S/C11H9ClN2/c12-9-4-3-8-6-13-11(7-1-2-7)14-10(8)5-9/h3-7H,1-2H2
InChIKeyJDBKHZPZXIVLQF-UHFFFAOYSA-N
MW204.66 g/mol
LogP3.16
Rot. Bonds1

About 7-chloro-2-cyclopropylquinazoline

7-chloro-2-cyclopropylquinazoline (PubChem CID 172741252) has the molecular formula C11H9ClN2 and a molecular weight of 204.66 g/mol. Its IUPAC name is 7-chloro-2-cyclopropylquinazoline.

Molecular Properties

Compound Name7-chloro-2-cyclopropylquinazoline
PubChem CID172741252
Molecular FormulaC11H9ClN2
Molecular Weight204.66 g/mol
Exact Mass204.05
IUPAC Name7-chloro-2-cyclopropylquinazoline
SMILESClc1ccc2cnc(C3CC3)nc2c1
InChIInChI=1S/C11H9ClN2/c12-9-4-3-8-6-13-11(7-1-2-7)14-10(8)5-9/h3-7H,1-2H2
InChIKeyJDBKHZPZXIVLQF-UHFFFAOYSA-N
XLogP3.16
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.66
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-chloro-2-cyclopropylquinazoline?
The IUPAC name of 7-chloro-2-cyclopropylquinazoline (CID 172741252) is 7-chloro-2-cyclopropylquinazoline.
What is the SMILES notation for 7-chloro-2-cyclopropylquinazoline?
The canonical SMILES for 7-chloro-2-cyclopropylquinazoline is Clc1ccc2cnc(C3CC3)nc2c1.
What is the InChIKey of 7-chloro-2-cyclopropylquinazoline?
The InChIKey is JDBKHZPZXIVLQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClN2/c12-9-4-3-8-6-13-11(7-1-2-7)14-10(8)5-9/h3-7H,1-2H2.
What are the key properties of 7-chloro-2-cyclopropylquinazoline?
7-chloro-2-cyclopropylquinazoline has a molecular weight of 204.66 g/mol, XLogP of 3.16, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-2-cyclopropylquinazoline is sourced from PubChem (CID 172741252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).