7-[(4-chloro-2-methoxyphenyl)methoxy]quinazoline

C16H13ClN2O2 — CID 70111487

IUPAC7-[(4-chloro-2-methoxyphenyl)methoxy]quinazoline
SMILESCOc1cc(Cl)ccc1COc1ccc2cncnc2c1
InChIInChI=1S/C16H13ClN2O2/c1-20-16-6-13(17)4-2-12(16)9-21-14-5-3-11-8-18-10-19-15(11)7-14/h2-8,10H,9H2,1H3
InChIKeyFYQYVNNINANYQJ-UHFFFAOYSA-N
MW300.75 g/mol
LogP3.87
Rot. Bonds4

About 7-[(4-chloro-2-methoxyphenyl)methoxy]quinazoline

7-[(4-chloro-2-methoxyphenyl)methoxy]quinazoline (PubChem CID 70111487) has the molecular formula C16H13ClN2O2 and a molecular weight of 300.75 g/mol. Its IUPAC name is 7-[(4-chloro-2-methoxyphenyl)methoxy]quinazoline.

Molecular Properties

Compound Name7-[(4-chloro-2-methoxyphenyl)methoxy]quinazoline
PubChem CID70111487
Molecular FormulaC16H13ClN2O2
Molecular Weight300.75 g/mol
Exact Mass300.07
IUPAC Name7-[(4-chloro-2-methoxyphenyl)methoxy]quinazoline
SMILESCOc1cc(Cl)ccc1COc1ccc2cncnc2c1
InChIInChI=1S/C16H13ClN2O2/c1-20-16-6-13(17)4-2-12(16)9-21-14-5-3-11-8-18-10-19-15(11)7-14/h2-8,10H,9H2,1H3
InChIKeyFYQYVNNINANYQJ-UHFFFAOYSA-N
XLogP3.87
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.75
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-2-[(4-methoxyphenoxy)methyl]phenol
CID 117221271
7-[(1R)-1-(4-methoxyphenyl)ethyl]quinazoline
CID 151497293
4-chloro-2-[(3-chlorophenoxy)methyl]-1-methoxybenzene
CID 64764179
1,4-dichloro-2-[(2-fluoro-4-methoxyphenyl)methoxy]benzene
CID 102879421
[2-[(5-chloro-2-methoxyphenyl)methoxy]-4-methoxyphenyl]methanol
CID 61268126
7-[(2-chlorophenyl)methoxy]quinoline
CID 91807412
2,4-bis[(2,4-dichlorophenyl)methoxy]benzaldehyde
CID 4767083
2-bromo-6-[(2,4-dichlorophenyl)methoxy]naphthalene
CID 60624704
N-[[5-[(5-chloro-2-methoxyphenyl)methoxy]-2-pyridinyl]methyl]ethanamine
CID 79782260
4-chloro-2-[(2-fluoro-4-methoxyphenyl)methoxy]benzoic acid
CID 102875975
4-[(5-chloro-2-methoxyphenyl)methoxy]-2-fluorobenzonitrile
CID 78952742
5-[(2,4-dimethoxyphenyl)methoxy]-1H-pyrrolo[2,3-b]pyridine
CID 25027180

Frequently Asked Questions

What is the IUPAC name of 7-[(4-chloro-2-methoxyphenyl)methoxy]quinazoline?
The IUPAC name of 7-[(4-chloro-2-methoxyphenyl)methoxy]quinazoline (CID 70111487) is 7-[(4-chloro-2-methoxyphenyl)methoxy]quinazoline.
What is the SMILES notation for 7-[(4-chloro-2-methoxyphenyl)methoxy]quinazoline?
The canonical SMILES for 7-[(4-chloro-2-methoxyphenyl)methoxy]quinazoline is COc1cc(Cl)ccc1COc1ccc2cncnc2c1.
What is the InChIKey of 7-[(4-chloro-2-methoxyphenyl)methoxy]quinazoline?
The InChIKey is FYQYVNNINANYQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13ClN2O2/c1-20-16-6-13(17)4-2-12(16)9-21-14-5-3-11-8-18-10-19-15(11)7-14/h2-8,10H,9H2,1H3.
What are the key properties of 7-[(4-chloro-2-methoxyphenyl)methoxy]quinazoline?
7-[(4-chloro-2-methoxyphenyl)methoxy]quinazoline has a molecular weight of 300.75 g/mol, XLogP of 3.87, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(4-chloro-2-methoxyphenyl)methoxy]quinazoline is sourced from PubChem (CID 70111487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).