4-(azetidin-1-yl)-6-ethyl-7-methoxyquinazoline

C14H17N3O — CID 176978917

IUPAC4-(azetidin-1-yl)-6-ethyl-7-methoxyquinazoline
SMILESCCc1cc2c(N3CCC3)ncnc2cc1OC
InChIInChI=1S/C14H17N3O/c1-3-10-7-11-12(8-13(10)18-2)15-9-16-14(11)17-5-4-6-17/h7-9H,3-6H2,1-2H3
InChIKeyCFYGGZMJVXHCAQ-UHFFFAOYSA-N
MW243.31 g/mol
LogP2.41
Rot. Bonds3

About 4-(azetidin-1-yl)-6-ethyl-7-methoxyquinazoline

4-(azetidin-1-yl)-6-ethyl-7-methoxyquinazoline (PubChem CID 176978917) has the molecular formula C14H17N3O and a molecular weight of 243.31 g/mol. Its IUPAC name is 4-(azetidin-1-yl)-6-ethyl-7-methoxyquinazoline.

Molecular Properties

Compound Name4-(azetidin-1-yl)-6-ethyl-7-methoxyquinazoline
PubChem CID176978917
Molecular FormulaC14H17N3O
Molecular Weight243.31 g/mol
Exact Mass243.14
IUPAC Name4-(azetidin-1-yl)-6-ethyl-7-methoxyquinazoline
SMILESCCc1cc2c(N3CCC3)ncnc2cc1OC
InChIInChI=1S/C14H17N3O/c1-3-10-7-11-12(8-13(10)18-2)15-9-16-14(11)17-5-4-6-17/h7-9H,3-6H2,1-2H3
InChIKeyCFYGGZMJVXHCAQ-UHFFFAOYSA-N
XLogP2.41
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 52.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-(6,7-dimethoxyquinazolin-4-yl)piperidin-4-one
CID 14738823
2-amino-1-[4-(6,7-dimethoxyquinazolin-4-yl)-1,4-diazepan-1-yl]ethanone
CID 156824002
7-fluoro-6-methoxy-4-pyrrolidin-1-ylquinazoline
CID 133475447
6,7-dimethoxy-4-(4-methylpiperazin-1-yl)quinazoline
CID 2808928
2-[4-(6,7-dimethoxyquinazolin-4-yl)-1,4-diazepan-1-yl]ethylsulfamic acid;hydrochloride
CID 166071329
4-(4-cyclopropylsulfonyl-1,4-diazepan-1-yl)-6,7-dimethoxyquinazoline
CID 154582894
[4-(6,7-dimethoxyquinazolin-4-yl)piperazin-1-yl]methylidenevanadium
CID 22954242
4-(6-ethoxy-7-methoxyquinazolin-4-yl)piperazine-1-carboxylic acid
CID 22707631
4-(6,7-dimethoxyquinazolin-4-yl)piperazine-1-carboxamide
CID 86756553
bis[(E)-[1-(6,7-dimethoxyquinazolin-4-yl)azepan-4-ylidene]methoxy]-oxophosphanium
CID 175450879
6,7-dimethoxy-4-[4-[3-(sulfamoylamino)propyl]-1,4-diazepan-1-yl]quinazoline
CID 166712968
(2S)-2-[1-(6,7-dimethoxyquinazolin-4-yl)piperidin-4-yl]butan-1-amine
CID 155128602

Frequently Asked Questions

What is the IUPAC name of 4-(azetidin-1-yl)-6-ethyl-7-methoxyquinazoline?
The IUPAC name of 4-(azetidin-1-yl)-6-ethyl-7-methoxyquinazoline (CID 176978917) is 4-(azetidin-1-yl)-6-ethyl-7-methoxyquinazoline.
What is the SMILES notation for 4-(azetidin-1-yl)-6-ethyl-7-methoxyquinazoline?
The canonical SMILES for 4-(azetidin-1-yl)-6-ethyl-7-methoxyquinazoline is CCc1cc2c(N3CCC3)ncnc2cc1OC.
What is the InChIKey of 4-(azetidin-1-yl)-6-ethyl-7-methoxyquinazoline?
The InChIKey is CFYGGZMJVXHCAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O/c1-3-10-7-11-12(8-13(10)18-2)15-9-16-14(11)17-5-4-6-17/h7-9H,3-6H2,1-2H3.
What are the key properties of 4-(azetidin-1-yl)-6-ethyl-7-methoxyquinazoline?
4-(azetidin-1-yl)-6-ethyl-7-methoxyquinazoline has a molecular weight of 243.31 g/mol, XLogP of 2.41, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(azetidin-1-yl)-6-ethyl-7-methoxyquinazoline is sourced from PubChem (CID 176978917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).