5-methoxy-4-(4-pyridin-3-ylpiperidin-1-yl)quinazoline

C19H20N4O — CID 136522483

IUPAC5-methoxy-4-(4-pyridin-3-ylpiperidin-1-yl)quinazoline
SMILESCOc1cccc2ncnc(N3CCC(c4cccnc4)CC3)c12
InChIInChI=1S/C19H20N4O/c1-24-17-6-2-5-16-18(17)19(22-13-21-16)23-10-7-14(8-11-23)15-4-3-9-20-12-15/h2-6,9,12-14H,7-8,10-11H2,1H3
InChIKeyLEHVZTHOYNMEGS-UHFFFAOYSA-N
MW320.40 g/mol
LogP3.42
Rot. Bonds3

About 5-methoxy-4-(4-pyridin-3-ylpiperidin-1-yl)quinazoline

5-methoxy-4-(4-pyridin-3-ylpiperidin-1-yl)quinazoline (PubChem CID 136522483) has the molecular formula C19H20N4O and a molecular weight of 320.40 g/mol. Its IUPAC name is 5-methoxy-4-(4-pyridin-3-ylpiperidin-1-yl)quinazoline.

Molecular Properties

Compound Name5-methoxy-4-(4-pyridin-3-ylpiperidin-1-yl)quinazoline
PubChem CID136522483
Molecular FormulaC19H20N4O
Molecular Weight320.40 g/mol
Exact Mass320.16
IUPAC Name5-methoxy-4-(4-pyridin-3-ylpiperidin-1-yl)quinazoline
SMILESCOc1cccc2ncnc(N3CCC(c4cccnc4)CC3)c12
InChIInChI=1S/C19H20N4O/c1-24-17-6-2-5-16-18(17)19(22-13-21-16)23-10-7-14(8-11-23)15-4-3-9-20-12-15/h2-6,9,12-14H,7-8,10-11H2,1H3
InChIKeyLEHVZTHOYNMEGS-UHFFFAOYSA-N
XLogP3.42
TPSA51.14 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.40
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-(5-methoxyquinazolin-4-yl)piperidin-3-yl]acetamide
CID 138042775
3-methoxy-1-(5-methoxyquinazolin-4-yl)pyrrolidine-3-carboxylic acid
CID 154771473
5-fluoro-4-(4-pyrimidin-2-yloxypiperidin-1-yl)quinazoline
CID 72881279
4-(4-bromopiperidin-1-yl)-5-methoxypyrimidine
CID 130543437
3-methoxy-2-(4-methylpiperidin-1-yl)pyridine
CID 155975394
1-(4-pyridin-3-ylpiperidin-1-yl)ethanone
CID 129301457
2-[4-(3-methoxyphenyl)piperidin-1-yl]pyridine-3-carbonitrile
CID 122136129
6-fluoro-4-(4-pyridin-4-ylpiperidin-1-yl)quinazoline
CID 126810422
amino-(4-pyridin-3-ylpiperidin-1-yl)methanol
CID 145342112
3-fluoro-2-[4-(2-methoxyphenyl)piperidin-1-yl]pyridine
CID 171914914
[1-(5-fluoroquinazolin-4-yl)piperidin-4-yl]-pyrrolidin-1-ylmethanone
CID 56816106
3-[1-[3-(6-methoxynaphthalen-2-yl)oxypropyl]piperidin-4-yl]pyridine
CID 21198085

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-4-(4-pyridin-3-ylpiperidin-1-yl)quinazoline?
The IUPAC name of 5-methoxy-4-(4-pyridin-3-ylpiperidin-1-yl)quinazoline (CID 136522483) is 5-methoxy-4-(4-pyridin-3-ylpiperidin-1-yl)quinazoline.
What is the SMILES notation for 5-methoxy-4-(4-pyridin-3-ylpiperidin-1-yl)quinazoline?
The canonical SMILES for 5-methoxy-4-(4-pyridin-3-ylpiperidin-1-yl)quinazoline is COc1cccc2ncnc(N3CCC(c4cccnc4)CC3)c12.
What is the InChIKey of 5-methoxy-4-(4-pyridin-3-ylpiperidin-1-yl)quinazoline?
The InChIKey is LEHVZTHOYNMEGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O/c1-24-17-6-2-5-16-18(17)19(22-13-21-16)23-10-7-14(8-11-23)15-4-3-9-20-12-15/h2-6,9,12-14H,7-8,10-11H2,1H3.
What are the key properties of 5-methoxy-4-(4-pyridin-3-ylpiperidin-1-yl)quinazoline?
5-methoxy-4-(4-pyridin-3-ylpiperidin-1-yl)quinazoline has a molecular weight of 320.40 g/mol, XLogP of 3.42, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-4-(4-pyridin-3-ylpiperidin-1-yl)quinazoline is sourced from PubChem (CID 136522483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).