4-methyl-2-(2-pyridin-4-ylethyl)quinazoline

C16H15N3 — CID 59888251

IUPAC4-methyl-2-(2-pyridin-4-ylethyl)quinazoline
SMILESCc1nc(CCc2ccncc2)nc2ccccc12
InChIInChI=1S/C16H15N3/c1-12-14-4-2-3-5-15(14)19-16(18-12)7-6-13-8-10-17-11-9-13/h2-5,8-11H,6-7H2,1H3
InChIKeyTXINZPZLSPNIMZ-UHFFFAOYSA-N
MW249.32 g/mol
LogP3.12
Rot. Bonds3

About 4-methyl-2-(2-pyridin-4-ylethyl)quinazoline

4-methyl-2-(2-pyridin-4-ylethyl)quinazoline (PubChem CID 59888251) has the molecular formula C16H15N3 and a molecular weight of 249.32 g/mol. Its IUPAC name is 4-methyl-2-(2-pyridin-4-ylethyl)quinazoline.

Molecular Properties

Compound Name4-methyl-2-(2-pyridin-4-ylethyl)quinazoline
PubChem CID59888251
Molecular FormulaC16H15N3
Molecular Weight249.32 g/mol
Exact Mass249.13
IUPAC Name4-methyl-2-(2-pyridin-4-ylethyl)quinazoline
SMILESCc1nc(CCc2ccncc2)nc2ccccc12
InChIInChI=1S/C16H15N3/c1-12-14-4-2-3-5-15(14)19-16(18-12)7-6-13-8-10-17-11-9-13/h2-5,8-11H,6-7H2,1H3
InChIKeyTXINZPZLSPNIMZ-UHFFFAOYSA-N
XLogP3.12
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.32
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(2-pyridin-4-ylethyl)quinazoline?
The IUPAC name of 4-methyl-2-(2-pyridin-4-ylethyl)quinazoline (CID 59888251) is 4-methyl-2-(2-pyridin-4-ylethyl)quinazoline.
What is the SMILES notation for 4-methyl-2-(2-pyridin-4-ylethyl)quinazoline?
The canonical SMILES for 4-methyl-2-(2-pyridin-4-ylethyl)quinazoline is Cc1nc(CCc2ccncc2)nc2ccccc12.
What is the InChIKey of 4-methyl-2-(2-pyridin-4-ylethyl)quinazoline?
The InChIKey is TXINZPZLSPNIMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3/c1-12-14-4-2-3-5-15(14)19-16(18-12)7-6-13-8-10-17-11-9-13/h2-5,8-11H,6-7H2,1H3.
What are the key properties of 4-methyl-2-(2-pyridin-4-ylethyl)quinazoline?
4-methyl-2-(2-pyridin-4-ylethyl)quinazoline has a molecular weight of 249.32 g/mol, XLogP of 3.12, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(2-pyridin-4-ylethyl)quinazoline is sourced from PubChem (CID 59888251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).