7-[(1R)-1-(4-methoxyphenyl)ethyl]quinazoline

C17H16N2O — CID 151497293

IUPAC7-[(1R)-1-(4-methoxyphenyl)ethyl]quinazoline
SMILESCOc1ccc([C@@H](C)c2ccc3cncnc3c2)cc1
InChIInChI=1S/C17H16N2O/c1-12(13-5-7-16(20-2)8-6-13)14-3-4-15-10-18-11-19-17(15)9-14/h3-12H,1-2H3/t12-/m1/s1
InChIKeyPPRITNPUCWBBNS-GFCCVEGCSA-N
MW264.33 g/mol
LogP3.79
Rot. Bonds3

About 7-[(1R)-1-(4-methoxyphenyl)ethyl]quinazoline

7-[(1R)-1-(4-methoxyphenyl)ethyl]quinazoline (PubChem CID 151497293) has the molecular formula C17H16N2O and a molecular weight of 264.33 g/mol. Its IUPAC name is 7-[(1R)-1-(4-methoxyphenyl)ethyl]quinazoline.

Molecular Properties

Compound Name7-[(1R)-1-(4-methoxyphenyl)ethyl]quinazoline
PubChem CID151497293
Molecular FormulaC17H16N2O
Molecular Weight264.33 g/mol
Exact Mass264.13
IUPAC Name7-[(1R)-1-(4-methoxyphenyl)ethyl]quinazoline
SMILESCOc1ccc([C@@H](C)c2ccc3cncnc3c2)cc1
InChIInChI=1S/C17H16N2O/c1-12(13-5-7-16(20-2)8-6-13)14-3-4-15-10-18-11-19-17(15)9-14/h3-12H,1-2H3/t12-/m1/s1
InChIKeyPPRITNPUCWBBNS-GFCCVEGCSA-N
XLogP3.79
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

7-(2-methylpropyl)quinazoline
CID 147255984
7-(4-methoxyphenyl)pyrido[2,3-d]pyrimidine
CID 141003075
4-[1-(4-methoxyphenyl)ethyl]aniline
CID 11644284
ethene;7-methylquinazoline
CID 145317995
7-methylsulfanylquinazoline
CID 89470405
7-[(4-chloro-2-methoxyphenyl)methoxy]quinazoline
CID 70111487
methanethiol;quinazolin-7-amine
CID 156844903
5-[4-[1-(4-methoxyphenyl)ethyl]phenyl]-1H-pyrrolo[2,3-b]pyridine
CID 175083824
3-[1-(4-methoxyphenyl)ethyl]benzonitrile
CID 173090876
6-methoxyquinazolin-7-ol;hydrochloride
CID 174888473
3-ethyl-7-methoxyquinoline
CID 14361549
1-(6-methoxyquinazolin-2-yl)-N-methylethanamine
CID 105471328

Frequently Asked Questions

What is the IUPAC name of 7-[(1R)-1-(4-methoxyphenyl)ethyl]quinazoline?
The IUPAC name of 7-[(1R)-1-(4-methoxyphenyl)ethyl]quinazoline (CID 151497293) is 7-[(1R)-1-(4-methoxyphenyl)ethyl]quinazoline.
What is the SMILES notation for 7-[(1R)-1-(4-methoxyphenyl)ethyl]quinazoline?
The canonical SMILES for 7-[(1R)-1-(4-methoxyphenyl)ethyl]quinazoline is COc1ccc([C@@H](C)c2ccc3cncnc3c2)cc1.
What is the InChIKey of 7-[(1R)-1-(4-methoxyphenyl)ethyl]quinazoline?
The InChIKey is PPRITNPUCWBBNS-GFCCVEGCSA-N. The full InChI is InChI=1S/C17H16N2O/c1-12(13-5-7-16(20-2)8-6-13)14-3-4-15-10-18-11-19-17(15)9-14/h3-12H,1-2H3/t12-/m1/s1.
What are the key properties of 7-[(1R)-1-(4-methoxyphenyl)ethyl]quinazoline?
7-[(1R)-1-(4-methoxyphenyl)ethyl]quinazoline has a molecular weight of 264.33 g/mol, XLogP of 3.79, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(1R)-1-(4-methoxyphenyl)ethyl]quinazoline is sourced from PubChem (CID 151497293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).