6-methyl-4-[4-[(6-methyl-3-pyridinyl)oxy]piperidin-1-yl]quinazoline

C20H22N4O — CID 127044706

IUPAC6-methyl-4-[4-[(6-methyl-3-pyridinyl)oxy]piperidin-1-yl]quinazoline
SMILESCc1ccc2ncnc(N3CCC(Oc4ccc(C)nc4)CC3)c2c1
InChIInChI=1S/C20H22N4O/c1-14-3-6-19-18(11-14)20(23-13-22-19)24-9-7-16(8-10-24)25-17-5-4-15(2)21-12-17/h3-6,11-13,16H,7-10H2,1-2H3
InChIKeyGAMKZRJKLNGZSK-UHFFFAOYSA-N
MW334.42 g/mol
LogP3.69
Rot. Bonds3

About 6-methyl-4-[4-[(6-methyl-3-pyridinyl)oxy]piperidin-1-yl]quinazoline

6-methyl-4-[4-[(6-methyl-3-pyridinyl)oxy]piperidin-1-yl]quinazoline (PubChem CID 127044706) has the molecular formula C20H22N4O and a molecular weight of 334.42 g/mol. Its IUPAC name is 6-methyl-4-[4-[(6-methyl-3-pyridinyl)oxy]piperidin-1-yl]quinazoline.

Molecular Properties

Compound Name6-methyl-4-[4-[(6-methyl-3-pyridinyl)oxy]piperidin-1-yl]quinazoline
PubChem CID127044706
Molecular FormulaC20H22N4O
Molecular Weight334.42 g/mol
Exact Mass334.18
IUPAC Name6-methyl-4-[4-[(6-methyl-3-pyridinyl)oxy]piperidin-1-yl]quinazoline
SMILESCc1ccc2ncnc(N3CCC(Oc4ccc(C)nc4)CC3)c2c1
InChIInChI=1S/C20H22N4O/c1-14-3-6-19-18(11-14)20(23-13-22-19)24-9-7-16(8-10-24)25-17-5-4-15(2)21-12-17/h3-6,11-13,16H,7-10H2,1-2H3
InChIKeyGAMKZRJKLNGZSK-UHFFFAOYSA-N
XLogP3.69
TPSA51.14 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-4-[4-[(6-methyl-3-pyridinyl)oxy]piperidin-1-yl]quinazoline?
The IUPAC name of 6-methyl-4-[4-[(6-methyl-3-pyridinyl)oxy]piperidin-1-yl]quinazoline (CID 127044706) is 6-methyl-4-[4-[(6-methyl-3-pyridinyl)oxy]piperidin-1-yl]quinazoline.
What is the SMILES notation for 6-methyl-4-[4-[(6-methyl-3-pyridinyl)oxy]piperidin-1-yl]quinazoline?
The canonical SMILES for 6-methyl-4-[4-[(6-methyl-3-pyridinyl)oxy]piperidin-1-yl]quinazoline is Cc1ccc2ncnc(N3CCC(Oc4ccc(C)nc4)CC3)c2c1.
What is the InChIKey of 6-methyl-4-[4-[(6-methyl-3-pyridinyl)oxy]piperidin-1-yl]quinazoline?
The InChIKey is GAMKZRJKLNGZSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O/c1-14-3-6-19-18(11-14)20(23-13-22-19)24-9-7-16(8-10-24)25-17-5-4-15(2)21-12-17/h3-6,11-13,16H,7-10H2,1-2H3.
What are the key properties of 6-methyl-4-[4-[(6-methyl-3-pyridinyl)oxy]piperidin-1-yl]quinazoline?
6-methyl-4-[4-[(6-methyl-3-pyridinyl)oxy]piperidin-1-yl]quinazoline has a molecular weight of 334.42 g/mol, XLogP of 3.69, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-[4-[(6-methyl-3-pyridinyl)oxy]piperidin-1-yl]quinazoline is sourced from PubChem (CID 127044706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).