4-chloro-6-methoxy-2-propylquinazoline

C12H13ClN2O — CID 106584452

IUPAC4-chloro-6-methoxy-2-propylquinazoline
SMILESCCCc1nc(Cl)c2cc(OC)ccc2n1
InChIInChI=1S/C12H13ClN2O/c1-3-4-11-14-10-6-5-8(16-2)7-9(10)12(13)15-11/h5-7H,3-4H2,1-2H3
InChIKeyCUAKWADXKUAULY-UHFFFAOYSA-N
MW236.70 g/mol
LogP3.24
Rot. Bonds3

About 4-chloro-6-methoxy-2-propylquinazoline

4-chloro-6-methoxy-2-propylquinazoline (PubChem CID 106584452) has the molecular formula C12H13ClN2O and a molecular weight of 236.70 g/mol. Its IUPAC name is 4-chloro-6-methoxy-2-propylquinazoline.

Molecular Properties

Compound Name4-chloro-6-methoxy-2-propylquinazoline
PubChem CID106584452
Molecular FormulaC12H13ClN2O
Molecular Weight236.70 g/mol
Exact Mass236.07
IUPAC Name4-chloro-6-methoxy-2-propylquinazoline
SMILESCCCc1nc(Cl)c2cc(OC)ccc2n1
InChIInChI=1S/C12H13ClN2O/c1-3-4-11-14-10-6-5-8(16-2)7-9(10)12(13)15-11/h5-7H,3-4H2,1-2H3
InChIKeyCUAKWADXKUAULY-UHFFFAOYSA-N
XLogP3.24
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.70
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-chloro-6-methoxy-2-propylquinazoline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-chloro-6-iodo-2-propylquinazoline
CID 10616606
2-chloro-6-methoxy-3-propylquinoline
CID 63231530
2-(4-amino-6-methoxyquinazolin-2-yl)ethanol
CID 105473832
4,6-dichloro-5-(2-chloro-5-methoxyphenoxy)-2-(2-methoxyethyl)pyrimidine
CID 54366186
4-chloro-6-methoxy-2-(5-methylthiophen-2-yl)quinazoline
CID 63086379
4-chloro-6-ethyl-2-(4-methoxyphenyl)quinazoline
CID 114590653
2-(4-chloro-6-methylquinazolin-2-yl)-N-methylethanamine
CID 105497222
N-(4-methoxyphenyl)-2-propylquinazolin-4-amine
CID 10756141
4-chloro-2-(2-chloroethyl)-6,7-dimethoxyquinazoline
CID 90236933
6-chloro-N-(3-methoxyphenyl)-5-methyl-2-propylpyrimidin-4-amine
CID 80971215
4-(4-chloro-6-methoxyquinolin-2-yl)-5-propyl-1,2-dihydropyrazol-3-one
CID 69058334
6-methoxy-1,2,3,4-tetrapropylnaphthalene
CID 101211335

Frequently Asked Questions

What is the IUPAC name of 4-chloro-6-methoxy-2-propylquinazoline?
The IUPAC name of 4-chloro-6-methoxy-2-propylquinazoline (CID 106584452) is 4-chloro-6-methoxy-2-propylquinazoline.
What is the SMILES notation for 4-chloro-6-methoxy-2-propylquinazoline?
The canonical SMILES for 4-chloro-6-methoxy-2-propylquinazoline is CCCc1nc(Cl)c2cc(OC)ccc2n1.
What is the InChIKey of 4-chloro-6-methoxy-2-propylquinazoline?
The InChIKey is CUAKWADXKUAULY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13ClN2O/c1-3-4-11-14-10-6-5-8(16-2)7-9(10)12(13)15-11/h5-7H,3-4H2,1-2H3.
What are the key properties of 4-chloro-6-methoxy-2-propylquinazoline?
4-chloro-6-methoxy-2-propylquinazoline has a molecular weight of 236.70 g/mol, XLogP of 3.24, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-6-methoxy-2-propylquinazoline is sourced from PubChem (CID 106584452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).