5-methyl-3-[(2R)-1-quinazolin-4-ylpyrrolidin-2-yl]-1,2-oxazole

C16H16N4O — CID 39998438

IUPAC5-methyl-3-[(2R)-1-quinazolin-4-ylpyrrolidin-2-yl]-1,2-oxazole
SMILESCc1cc([C@H]2CCCN2c2ncnc3ccccc23)no1
InChIInChI=1S/C16H16N4O/c1-11-9-14(19-21-11)15-7-4-8-20(15)16-12-5-2-3-6-13(12)17-10-18-16/h2-3,5-6,9-10,15H,4,7-8H2,1H3/t15-/m1/s1
InChIKeyVEUDMNYMHGUPCS-OAHLLOKOSA-N
MW280.33 g/mol
LogP3.27
Rot. Bonds2

About 5-methyl-3-[(2R)-1-quinazolin-4-ylpyrrolidin-2-yl]-1,2-oxazole

5-methyl-3-[(2R)-1-quinazolin-4-ylpyrrolidin-2-yl]-1,2-oxazole (PubChem CID 39998438) has the molecular formula C16H16N4O and a molecular weight of 280.33 g/mol. Its IUPAC name is 5-methyl-3-[(2R)-1-quinazolin-4-ylpyrrolidin-2-yl]-1,2-oxazole.

Molecular Properties

Compound Name5-methyl-3-[(2R)-1-quinazolin-4-ylpyrrolidin-2-yl]-1,2-oxazole
PubChem CID39998438
Molecular FormulaC16H16N4O
Molecular Weight280.33 g/mol
Exact Mass280.13
IUPAC Name5-methyl-3-[(2R)-1-quinazolin-4-ylpyrrolidin-2-yl]-1,2-oxazole
SMILESCc1cc([C@H]2CCCN2c2ncnc3ccccc23)no1
InChIInChI=1S/C16H16N4O/c1-11-9-14(19-21-11)15-7-4-8-20(15)16-12-5-2-3-6-13(12)17-10-18-16/h2-3,5-6,9-10,15H,4,7-8H2,1H3/t15-/m1/s1
InChIKeyVEUDMNYMHGUPCS-OAHLLOKOSA-N
XLogP3.27
TPSA55.05 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 5-methyl-3-[(2R)-1-quinazolin-4-ylpyrrolidin-2-yl]-1,2-oxazole 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

5-methyl-3-[(2S)-1-pyrimidin-2-ylpyrrolidin-2-yl]-1,2-oxazole
CID 39998429
(3-methylpiperidin-1-yl)-(1-quinazolin-4-ylpyrrolidin-2-yl)methanone
CID 110437049
2-methyl-1-quinazolin-4-ylpiperidin-4-amine
CID 66801029
2-[[(2R)-2-(5-methyl-1,2-oxazol-3-yl)pyrrolidin-1-yl]methyl]phenol
CID 92732581
N-[(1-quinazolin-4-ylpyrrolidin-2-yl)methyl]cyclopropanamine
CID 62591283
N-methyl-1-(1-quinazolin-4-ylpiperidin-2-yl)methanamine
CID 62586937
N-(1-phenylethyl)-1-quinazolin-4-ylpyrrolidine-2-carboxamide
CID 110436322
N-cyclopropyl-5-[(2S)-1-(8-methylquinazolin-4-yl)pyrrolidin-2-yl]-1,2,4-oxadiazole-3-carboxamide
CID 129337947
7-chloro-4-[2-(furan-2-yl)pyrrolidin-1-yl]quinazoline
CID 86962318
(2R,5R)-2,5-dimethyl-4-quinazolin-4-ylmorpholine
CID 51672171
4-(2-methylpiperazin-1-yl)quinazoline
CID 62673888
4-[(2R)-2-(pyrazol-1-ylmethyl)pyrrolidin-1-yl]quinazoline
CID 95338499

Frequently Asked Questions

What is the IUPAC name of 5-methyl-3-[(2R)-1-quinazolin-4-ylpyrrolidin-2-yl]-1,2-oxazole?
The IUPAC name of 5-methyl-3-[(2R)-1-quinazolin-4-ylpyrrolidin-2-yl]-1,2-oxazole (CID 39998438) is 5-methyl-3-[(2R)-1-quinazolin-4-ylpyrrolidin-2-yl]-1,2-oxazole.
What is the SMILES notation for 5-methyl-3-[(2R)-1-quinazolin-4-ylpyrrolidin-2-yl]-1,2-oxazole?
The canonical SMILES for 5-methyl-3-[(2R)-1-quinazolin-4-ylpyrrolidin-2-yl]-1,2-oxazole is Cc1cc([C@H]2CCCN2c2ncnc3ccccc23)no1.
What is the InChIKey of 5-methyl-3-[(2R)-1-quinazolin-4-ylpyrrolidin-2-yl]-1,2-oxazole?
The InChIKey is VEUDMNYMHGUPCS-OAHLLOKOSA-N. The full InChI is InChI=1S/C16H16N4O/c1-11-9-14(19-21-11)15-7-4-8-20(15)16-12-5-2-3-6-13(12)17-10-18-16/h2-3,5-6,9-10,15H,4,7-8H2,1H3/t15-/m1/s1.
What are the key properties of 5-methyl-3-[(2R)-1-quinazolin-4-ylpyrrolidin-2-yl]-1,2-oxazole?
5-methyl-3-[(2R)-1-quinazolin-4-ylpyrrolidin-2-yl]-1,2-oxazole has a molecular weight of 280.33 g/mol, XLogP of 3.27, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3-[(2R)-1-quinazolin-4-ylpyrrolidin-2-yl]-1,2-oxazole is sourced from PubChem (CID 39998438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).