4-(4-cyclohexyloxypiperidin-1-yl)-6-methylquinazoline

C20H27N3O — CID 133278333

IUPAC4-(4-cyclohexyloxypiperidin-1-yl)-6-methylquinazoline
SMILESCc1ccc2ncnc(N3CCC(OC4CCCCC4)CC3)c2c1
InChIInChI=1S/C20H27N3O/c1-15-7-8-19-18(13-15)20(22-14-21-19)23-11-9-17(10-12-23)24-16-5-3-2-4-6-16/h7-8,13-14,16-17H,2-6,9-12H2,1H3
InChIKeyUXNBYCNQIUXZOP-UHFFFAOYSA-N
MW325.46 g/mol
LogP4.26
Rot. Bonds3

About 4-(4-cyclohexyloxypiperidin-1-yl)-6-methylquinazoline

4-(4-cyclohexyloxypiperidin-1-yl)-6-methylquinazoline (PubChem CID 133278333) has the molecular formula C20H27N3O and a molecular weight of 325.46 g/mol. Its IUPAC name is 4-(4-cyclohexyloxypiperidin-1-yl)-6-methylquinazoline.

Molecular Properties

Compound Name4-(4-cyclohexyloxypiperidin-1-yl)-6-methylquinazoline
PubChem CID133278333
Molecular FormulaC20H27N3O
Molecular Weight325.46 g/mol
Exact Mass325.22
IUPAC Name4-(4-cyclohexyloxypiperidin-1-yl)-6-methylquinazoline
SMILESCc1ccc2ncnc(N3CCC(OC4CCCCC4)CC3)c2c1
InChIInChI=1S/C20H27N3O/c1-15-7-8-19-18(13-15)20(22-14-21-19)23-11-9-17(10-12-23)24-16-5-3-2-4-6-16/h7-8,13-14,16-17H,2-6,9-12H2,1H3
InChIKeyUXNBYCNQIUXZOP-UHFFFAOYSA-N
XLogP4.26
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.46
LogP ≤ 54.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

trans-(1S,2S)-2-[4-(6-methylquinazolin-4-yl)piperazin-1-yl]cyclohexan-1-ol
CID 56853258
6-methyl-4-(3-methylsulfanylazepan-1-yl)quinazoline
CID 133395119
6-methyl-4-[4-(1-methylpyrazol-4-yl)piperidin-1-yl]quinazoline
CID 133300671
6-methyl-3-[1-(6-methylquinazolin-4-yl)piperidin-4-yl]-1H-benzimidazol-2-one
CID 139785898
4-(3,3-difluoropyrrolidin-1-yl)-6-methylquinazoline
CID 136520741
4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-6-methylquinazoline
CID 112843750
4-(azepan-1-yl)-6-methoxyquinazoline
CID 21002922
[methylamino-[4-(6-methylquinazolin-4-yl)piperazin-1-yl]methylidene]vanadium
CID 59928286
3-[[1-(6,7-dimethoxyquinazolin-4-yl)piperidin-4-yl]methyl]-6-methylquinazolin-4-one
CID 139800859
4-cyclohexyl-1-(6-methylsulfanylquinazolin-4-yl)piperidin-4-ol
CID 167836092
(1S,3R)-3-ethoxy-7-(6-methylquinazolin-4-yl)-7-azaspiro[3.5]nonan-1-ol
CID 97100878
N-[1-(6-fluoroquinazolin-4-yl)piperidin-4-yl]-6-methylpyrimidin-4-amine
CID 126887875

Frequently Asked Questions

What is the IUPAC name of 4-(4-cyclohexyloxypiperidin-1-yl)-6-methylquinazoline?
The IUPAC name of 4-(4-cyclohexyloxypiperidin-1-yl)-6-methylquinazoline (CID 133278333) is 4-(4-cyclohexyloxypiperidin-1-yl)-6-methylquinazoline.
What is the SMILES notation for 4-(4-cyclohexyloxypiperidin-1-yl)-6-methylquinazoline?
The canonical SMILES for 4-(4-cyclohexyloxypiperidin-1-yl)-6-methylquinazoline is Cc1ccc2ncnc(N3CCC(OC4CCCCC4)CC3)c2c1.
What is the InChIKey of 4-(4-cyclohexyloxypiperidin-1-yl)-6-methylquinazoline?
The InChIKey is UXNBYCNQIUXZOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N3O/c1-15-7-8-19-18(13-15)20(22-14-21-19)23-11-9-17(10-12-23)24-16-5-3-2-4-6-16/h7-8,13-14,16-17H,2-6,9-12H2,1H3.
What are the key properties of 4-(4-cyclohexyloxypiperidin-1-yl)-6-methylquinazoline?
4-(4-cyclohexyloxypiperidin-1-yl)-6-methylquinazoline has a molecular weight of 325.46 g/mol, XLogP of 4.26, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-cyclohexyloxypiperidin-1-yl)-6-methylquinazoline is sourced from PubChem (CID 133278333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).