4-methoxy-2-pyridin-4-ylquinazoline

C14H11N3O — CID 710968

IUPAC4-methoxy-2-pyridin-4-ylquinazoline
SMILESCOc1nc(-c2ccncc2)nc2ccccc12
InChIInChI=1S/C14H11N3O/c1-18-14-11-4-2-3-5-12(11)16-13(17-14)10-6-8-15-9-7-10/h2-9H,1H3
InChIKeyCITNOEGVWLNGTQ-UHFFFAOYSA-N
MW237.26 g/mol
LogP2.70
Rot. Bonds2

About 4-methoxy-2-pyridin-4-ylquinazoline

4-methoxy-2-pyridin-4-ylquinazoline (PubChem CID 710968) has the molecular formula C14H11N3O and a molecular weight of 237.26 g/mol. Its IUPAC name is 4-methoxy-2-pyridin-4-ylquinazoline.

Molecular Properties

Compound Name4-methoxy-2-pyridin-4-ylquinazoline
PubChem CID710968
Molecular FormulaC14H11N3O
Molecular Weight237.26 g/mol
Exact Mass237.09
IUPAC Name4-methoxy-2-pyridin-4-ylquinazoline
SMILESCOc1nc(-c2ccncc2)nc2ccccc12
InChIInChI=1S/C14H11N3O/c1-18-14-11-4-2-3-5-12(11)16-13(17-14)10-6-8-15-9-7-10/h2-9H,1H3
InChIKeyCITNOEGVWLNGTQ-UHFFFAOYSA-N
XLogP2.70
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.26
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-pyridin-4-ylquinazoline?
The IUPAC name of 4-methoxy-2-pyridin-4-ylquinazoline (CID 710968) is 4-methoxy-2-pyridin-4-ylquinazoline.
What is the SMILES notation for 4-methoxy-2-pyridin-4-ylquinazoline?
The canonical SMILES for 4-methoxy-2-pyridin-4-ylquinazoline is COc1nc(-c2ccncc2)nc2ccccc12.
What is the InChIKey of 4-methoxy-2-pyridin-4-ylquinazoline?
The InChIKey is CITNOEGVWLNGTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N3O/c1-18-14-11-4-2-3-5-12(11)16-13(17-14)10-6-8-15-9-7-10/h2-9H,1H3.
What are the key properties of 4-methoxy-2-pyridin-4-ylquinazoline?
4-methoxy-2-pyridin-4-ylquinazoline has a molecular weight of 237.26 g/mol, XLogP of 2.70, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-pyridin-4-ylquinazoline is sourced from PubChem (CID 710968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).