4-(3,3-dimethylazetidin-1-yl)-2-methylquinazoline

C14H17N3 — CID 178089563

IUPAC4-(3,3-dimethylazetidin-1-yl)-2-methylquinazoline
SMILESCc1nc(N2CC(C)(C)C2)c2ccccc2n1
InChIInChI=1S/C14H17N3/c1-10-15-12-7-5-4-6-11(12)13(16-10)17-8-14(2,3)9-17/h4-7H,8-9H2,1-3H3
InChIKeyVIOCLMHPOZZMCA-UHFFFAOYSA-N
MW227.31 g/mol
LogP2.78
Rot. Bonds1

About 4-(3,3-dimethylazetidin-1-yl)-2-methylquinazoline

4-(3,3-dimethylazetidin-1-yl)-2-methylquinazoline (PubChem CID 178089563) has the molecular formula C14H17N3 and a molecular weight of 227.31 g/mol. Its IUPAC name is 4-(3,3-dimethylazetidin-1-yl)-2-methylquinazoline.

Molecular Properties

Compound Name4-(3,3-dimethylazetidin-1-yl)-2-methylquinazoline
PubChem CID178089563
Molecular FormulaC14H17N3
Molecular Weight227.31 g/mol
Exact Mass227.14
IUPAC Name4-(3,3-dimethylazetidin-1-yl)-2-methylquinazoline
SMILESCc1nc(N2CC(C)(C)C2)c2ccccc2n1
InChIInChI=1S/C14H17N3/c1-10-15-12-7-5-4-6-11(12)13(16-10)17-8-14(2,3)9-17/h4-7H,8-9H2,1-3H3
InChIKeyVIOCLMHPOZZMCA-UHFFFAOYSA-N
XLogP2.78
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-(azepan-1-yl)-2-methylquinazoline chloride
CID 53351740
2-methyl-4-(4-piperidin-1-ylsulfonyl-1,4-diazepan-1-yl)quinazoline
CID 134706927
(3R,4R)-3-(hydroxymethyl)-1-(2-methylquinazolin-4-yl)piperidin-4-ol
CID 134710020
2-[1-(2-methylquinazolin-4-yl)piperidin-4-yl]ethylphosphonous acid
CID 142542808
2-methyl-4-[4-[2-(1-phenyltriazol-4-yl)propan-2-yl]piperazin-1-yl]quinazoline
CID 160989115
4-[4-[2-(3,5-dimethyl-1-phenylpyrazol-4-yl)propan-2-yl]piperazin-1-yl]-2-methylquinazoline;ethane
CID 162230257
2-methyl-4-propylquinazoline
CID 22419316
2-methyl-4-pyrrolo[3,2-c]pyridin-1-ylquinazoline
CID 58820202
2-(difluoromethyl)-4-(4,4-dimethylazepan-1-yl)quinazoline
CID 133322934
2-chloro-4-(3,4-dimethoxypyrrolidin-1-yl)quinazoline
CID 103536646
2-methyl-4-(5-nitro-2,3-dihydroindol-1-yl)quinazoline
CID 143177758
4-[5-[2-(3,5-dimethyl-1-phenylpyrazol-4-yl)propan-2-yl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-2-yl]-2-methylquinazoline;ethane
CID 157410734

Frequently Asked Questions

What is the IUPAC name of 4-(3,3-dimethylazetidin-1-yl)-2-methylquinazoline?
The IUPAC name of 4-(3,3-dimethylazetidin-1-yl)-2-methylquinazoline (CID 178089563) is 4-(3,3-dimethylazetidin-1-yl)-2-methylquinazoline.
What is the SMILES notation for 4-(3,3-dimethylazetidin-1-yl)-2-methylquinazoline?
The canonical SMILES for 4-(3,3-dimethylazetidin-1-yl)-2-methylquinazoline is Cc1nc(N2CC(C)(C)C2)c2ccccc2n1.
What is the InChIKey of 4-(3,3-dimethylazetidin-1-yl)-2-methylquinazoline?
The InChIKey is VIOCLMHPOZZMCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3/c1-10-15-12-7-5-4-6-11(12)13(16-10)17-8-14(2,3)9-17/h4-7H,8-9H2,1-3H3.
What are the key properties of 4-(3,3-dimethylazetidin-1-yl)-2-methylquinazoline?
4-(3,3-dimethylazetidin-1-yl)-2-methylquinazoline has a molecular weight of 227.31 g/mol, XLogP of 2.78, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,3-dimethylazetidin-1-yl)-2-methylquinazoline is sourced from PubChem (CID 178089563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).