3-methyl-1-[6-(1,3-oxazol-5-yl)-4-propylquinazolin-2-yl]butan-1-amine

C19H24N4O — CID 121263830

IUPAC3-methyl-1-[6-(1,3-oxazol-5-yl)-4-propylquinazolin-2-yl]butan-1-amine
SMILESCCCc1nc(C(N)CC(C)C)nc2ccc(-c3cnco3)cc12
InChIInChI=1S/C19H24N4O/c1-4-5-16-14-9-13(18-10-21-11-24-18)6-7-17(14)23-19(22-16)15(20)8-12(2)3/h6-7,9-12,15H,4-5,8,20H2,1-3H3
InChIKeyJFMIVGZVXAYZIQ-UHFFFAOYSA-N
MW324.43 g/mol
LogP4.28
Rot. Bonds6

About 3-methyl-1-[6-(1,3-oxazol-5-yl)-4-propylquinazolin-2-yl]butan-1-amine

3-methyl-1-[6-(1,3-oxazol-5-yl)-4-propylquinazolin-2-yl]butan-1-amine (PubChem CID 121263830) has the molecular formula C19H24N4O and a molecular weight of 324.43 g/mol. Its IUPAC name is 3-methyl-1-[6-(1,3-oxazol-5-yl)-4-propylquinazolin-2-yl]butan-1-amine.

Molecular Properties

Compound Name3-methyl-1-[6-(1,3-oxazol-5-yl)-4-propylquinazolin-2-yl]butan-1-amine
PubChem CID121263830
Molecular FormulaC19H24N4O
Molecular Weight324.43 g/mol
Exact Mass324.20
IUPAC Name3-methyl-1-[6-(1,3-oxazol-5-yl)-4-propylquinazolin-2-yl]butan-1-amine
SMILESCCCc1nc(C(N)CC(C)C)nc2ccc(-c3cnco3)cc12
InChIInChI=1S/C19H24N4O/c1-4-5-16-14-9-13(18-10-21-11-24-18)6-7-17(14)23-19(22-16)15(20)8-12(2)3/h6-7,9-12,15H,4-5,8,20H2,1-3H3
InChIKeyJFMIVGZVXAYZIQ-UHFFFAOYSA-N
XLogP4.28
TPSA77.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-methyl-1-[6-(1,3-oxazol-5-yl)-4-propylquinazolin-2-yl]butan-1-amine with MolForge

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Related Compounds

(1S)-1-[4-ethyl-6-(1,3-oxazol-5-yl)quinazolin-2-yl]-3-methylbutan-1-amine
CID 162625321
3-(2-aminoquinazolin-6-yl)-4-methyl-1-(4-(oxazol-2-yl)phenyl)pyridin-2(1H)-one
CID 24879368
[2-Methoxy-6-(3-oxazol-5-yl-phenyl)-pyrimidin-4-yl]-[2-(4-methoxy-phenyl)-ethyl]-amine
CID 53324534
1-[4-Methoxy-6-(1,3-oxazol-5-yl)quinazolin-2-yl]-3-methylbutan-1-amine
CID 121255719
2-(1-amino-3-methylbutyl)-N-methyl-6-(1,3-oxazol-5-yl)quinazolin-4-amine
CID 121255746
2-(1-Amino-3-methylbutyl)-7-methoxy-6-(1,3-oxazol-5-yl)quinazoline-4-carbonitrile
CID 121255756
2-(1-amino-3-methylbutyl)-N,N-dimethyl-6-(1,3-oxazol-5-yl)quinazolin-4-amine
CID 121255769
1-[4-Ethyl-7-methoxy-6-(1,3-oxazol-5-yl)quinazolin-2-yl]-3-methylbutan-1-amine
CID 121255772
2-(1-Amino-3-methylbutyl)-6-(1,3-oxazol-5-yl)quinazoline-4-carbonitrile
CID 121255790
1-[7-Methoxy-6-(1,3-oxazol-5-yl)quinazolin-2-yl]-3-methylbutan-1-amine
CID 121255805
1-[4-Ethoxy-6-(1,3-oxazol-5-yl)quinazolin-2-yl]-3-methylbutan-1-amine
CID 121255811
1-[5-Methoxy-6-(1,3-oxazol-5-yl)quinazolin-2-yl]-3-methylbutan-1-amine
CID 121255817

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-[6-(1,3-oxazol-5-yl)-4-propylquinazolin-2-yl]butan-1-amine?
The IUPAC name of 3-methyl-1-[6-(1,3-oxazol-5-yl)-4-propylquinazolin-2-yl]butan-1-amine (CID 121263830) is 3-methyl-1-[6-(1,3-oxazol-5-yl)-4-propylquinazolin-2-yl]butan-1-amine.
What is the SMILES notation for 3-methyl-1-[6-(1,3-oxazol-5-yl)-4-propylquinazolin-2-yl]butan-1-amine?
The canonical SMILES for 3-methyl-1-[6-(1,3-oxazol-5-yl)-4-propylquinazolin-2-yl]butan-1-amine is CCCc1nc(C(N)CC(C)C)nc2ccc(-c3cnco3)cc12.
What is the InChIKey of 3-methyl-1-[6-(1,3-oxazol-5-yl)-4-propylquinazolin-2-yl]butan-1-amine?
The InChIKey is JFMIVGZVXAYZIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O/c1-4-5-16-14-9-13(18-10-21-11-24-18)6-7-17(14)23-19(22-16)15(20)8-12(2)3/h6-7,9-12,15H,4-5,8,20H2,1-3H3.
What are the key properties of 3-methyl-1-[6-(1,3-oxazol-5-yl)-4-propylquinazolin-2-yl]butan-1-amine?
3-methyl-1-[6-(1,3-oxazol-5-yl)-4-propylquinazolin-2-yl]butan-1-amine has a molecular weight of 324.43 g/mol, XLogP of 4.28, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-[6-(1,3-oxazol-5-yl)-4-propylquinazolin-2-yl]butan-1-amine is sourced from PubChem (CID 121263830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).