6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(furan-2-ylmethyl)-N-methylquinazolin-4-amine

C19H18N4O2 — CID 3233693

IUPAC6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(furan-2-ylmethyl)-N-methylquinazolin-4-amine
SMILESCc1noc(C)c1-c1ccc2ncnc(N(C)Cc3ccco3)c2c1
InChIInChI=1S/C19H18N4O2/c1-12-18(13(2)25-22-12)14-6-7-17-16(9-14)19(21-11-20-17)23(3)10-15-5-4-8-24-15/h4-9,11H,10H2,1-3H3
InChIKeyZSIIVCZRLGNNHQ-UHFFFAOYSA-N
MW334.38 g/mol
LogP4.13
Rot. Bonds4

About 6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(furan-2-ylmethyl)-N-methylquinazolin-4-amine

6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(furan-2-ylmethyl)-N-methylquinazolin-4-amine (PubChem CID 3233693) has the molecular formula C19H18N4O2 and a molecular weight of 334.38 g/mol. Its IUPAC name is 6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(furan-2-ylmethyl)-N-methylquinazolin-4-amine.

Molecular Properties

Compound Name6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(furan-2-ylmethyl)-N-methylquinazolin-4-amine
PubChem CID3233693
Molecular FormulaC19H18N4O2
Molecular Weight334.38 g/mol
Exact Mass334.14
IUPAC Name6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(furan-2-ylmethyl)-N-methylquinazolin-4-amine
SMILESCc1noc(C)c1-c1ccc2ncnc(N(C)Cc3ccco3)c2c1
InChIInChI=1S/C19H18N4O2/c1-12-18(13(2)25-22-12)14-6-7-17-16(9-14)19(21-11-20-17)23(3)10-15-5-4-8-24-15/h4-9,11H,10H2,1-3H3
InChIKeyZSIIVCZRLGNNHQ-UHFFFAOYSA-N
XLogP4.13
TPSA68.19 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 54.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(furan-2-ylmethyl)-N-methylquinazolin-4-amine?
The IUPAC name of 6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(furan-2-ylmethyl)-N-methylquinazolin-4-amine (CID 3233693) is 6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(furan-2-ylmethyl)-N-methylquinazolin-4-amine.
What is the SMILES notation for 6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(furan-2-ylmethyl)-N-methylquinazolin-4-amine?
The canonical SMILES for 6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(furan-2-ylmethyl)-N-methylquinazolin-4-amine is Cc1noc(C)c1-c1ccc2ncnc(N(C)Cc3ccco3)c2c1.
What is the InChIKey of 6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(furan-2-ylmethyl)-N-methylquinazolin-4-amine?
The InChIKey is ZSIIVCZRLGNNHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O2/c1-12-18(13(2)25-22-12)14-6-7-17-16(9-14)19(21-11-20-17)23(3)10-15-5-4-8-24-15/h4-9,11H,10H2,1-3H3.
What are the key properties of 6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(furan-2-ylmethyl)-N-methylquinazolin-4-amine?
6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(furan-2-ylmethyl)-N-methylquinazolin-4-amine has a molecular weight of 334.38 g/mol, XLogP of 4.13, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(furan-2-ylmethyl)-N-methylquinazolin-4-amine is sourced from PubChem (CID 3233693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).