(4-hydroxyphenyl)-[1-(6-methoxyquinoline-2-carbonyl)piperidin-4-yl]methanone

C23H22N2O4 — CID 78836706

IUPAC(4-hydroxyphenyl)-[1-(6-methoxyquinoline-2-carbonyl)piperidin-4-yl]methanone
SMILESCOc1ccc2nc(C(=O)N3CCC(C(=O)c4ccc(O)cc4)CC3)ccc2c1
InChIInChI=1S/C23H22N2O4/c1-29-19-7-9-20-17(14-19)4-8-21(24-20)23(28)25-12-10-16(11-13-25)22(27)15-2-5-18(26)6-3-15/h2-9,14,16,26H,10-13H2,1H3
InChIKeyMRPXHYCZDJXSKM-UHFFFAOYSA-N
MW390.44 g/mol
LogP3.68
Rot. Bonds4

About (4-hydroxyphenyl)-[1-(6-methoxyquinoline-2-carbonyl)piperidin-4-yl]methanone

(4-hydroxyphenyl)-[1-(6-methoxyquinoline-2-carbonyl)piperidin-4-yl]methanone (PubChem CID 78836706) has the molecular formula C23H22N2O4 and a molecular weight of 390.44 g/mol. Its IUPAC name is (4-hydroxyphenyl)-[1-(6-methoxyquinoline-2-carbonyl)piperidin-4-yl]methanone.

Molecular Properties

Compound Name(4-hydroxyphenyl)-[1-(6-methoxyquinoline-2-carbonyl)piperidin-4-yl]methanone
PubChem CID78836706
Molecular FormulaC23H22N2O4
Molecular Weight390.44 g/mol
Exact Mass390.16
IUPAC Name(4-hydroxyphenyl)-[1-(6-methoxyquinoline-2-carbonyl)piperidin-4-yl]methanone
SMILESCOc1ccc2nc(C(=O)N3CCC(C(=O)c4ccc(O)cc4)CC3)ccc2c1
InChIInChI=1S/C23H22N2O4/c1-29-19-7-9-20-17(14-19)4-8-21(24-20)23(28)25-12-10-16(11-13-25)22(27)15-2-5-18(26)6-3-15/h2-9,14,16,26H,10-13H2,1H3
InChIKeyMRPXHYCZDJXSKM-UHFFFAOYSA-N
XLogP3.68
TPSA79.73 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.44
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (4-hydroxyphenyl)-[1-(6-methoxyquinoline-2-carbonyl)piperidin-4-yl]methanone with MolForge

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Related Compounds

(4-methoxypiperidin-1-yl)-(6-methoxyquinolin-2-yl)methanone
CID 56810636
(4-methoxyphenyl)-[1-(quinoxaline-2-carbonyl)piperidin-4-yl]methanone
CID 33365935
N-butyl-1-(6-methoxyquinoline-2-carbonyl)piperidine-4-carboxamide
CID 86985203
(4-hydroxyphenyl)-[1-[2-(4-methoxyphenyl)quinoline-4-carbonyl]piperidin-4-yl]methanone
CID 24615482
(4-methoxyphenyl)-[1-(6-methoxypyridine-3-carbonyl)piperidin-4-yl]methanone
CID 25475529
[3-(dimethylamino)-4-methylpyrrolidin-1-yl]-(6-methoxyquinolin-2-yl)methanone
CID 71927992
[1-(2-chlorobenzoyl)piperidin-4-yl]-(4-methoxyphenyl)methanone
CID 25473798
(4-methoxyphenyl)-[1-(1-piperidin-4-yltriazole-4-carbonyl)piperidin-4-yl]methanone;hydrochloride
CID 119699792
N-[3-[4-(4-methoxybenzoyl)piperidine-1-carbonyl]phenyl]acetamide
CID 25474514
(6-methoxyquinolin-2-yl)-[4-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazin-3-yl)piperidin-1-yl]methanone;dihydrochloride
CID 120833344
[2-(2-hydroxyethyl)piperidin-1-yl]-(6-methoxyquinolin-2-yl)methanone
CID 110887007
(4-methoxyphenyl)-[1-(2-phenyltriazole-4-carbonyl)piperidin-4-yl]methanone
CID 51324265

Frequently Asked Questions

What is the IUPAC name of (4-hydroxyphenyl)-[1-(6-methoxyquinoline-2-carbonyl)piperidin-4-yl]methanone?
The IUPAC name of (4-hydroxyphenyl)-[1-(6-methoxyquinoline-2-carbonyl)piperidin-4-yl]methanone (CID 78836706) is (4-hydroxyphenyl)-[1-(6-methoxyquinoline-2-carbonyl)piperidin-4-yl]methanone.
What is the SMILES notation for (4-hydroxyphenyl)-[1-(6-methoxyquinoline-2-carbonyl)piperidin-4-yl]methanone?
The canonical SMILES for (4-hydroxyphenyl)-[1-(6-methoxyquinoline-2-carbonyl)piperidin-4-yl]methanone is COc1ccc2nc(C(=O)N3CCC(C(=O)c4ccc(O)cc4)CC3)ccc2c1.
What is the InChIKey of (4-hydroxyphenyl)-[1-(6-methoxyquinoline-2-carbonyl)piperidin-4-yl]methanone?
The InChIKey is MRPXHYCZDJXSKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N2O4/c1-29-19-7-9-20-17(14-19)4-8-21(24-20)23(28)25-12-10-16(11-13-25)22(27)15-2-5-18(26)6-3-15/h2-9,14,16,26H,10-13H2,1H3.
What are the key properties of (4-hydroxyphenyl)-[1-(6-methoxyquinoline-2-carbonyl)piperidin-4-yl]methanone?
(4-hydroxyphenyl)-[1-(6-methoxyquinoline-2-carbonyl)piperidin-4-yl]methanone has a molecular weight of 390.44 g/mol, XLogP of 3.68, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4-hydroxyphenyl)-[1-(6-methoxyquinoline-2-carbonyl)piperidin-4-yl]methanone is sourced from PubChem (CID 78836706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).