1-[4-[4-(morpholin-4-ylmethyl)piperidine-1-carbonyl]phenyl]piperidin-2-one

C22H31N3O3 — CID 55748028

IUPAC1-[4-[4-(morpholin-4-ylmethyl)piperidine-1-carbonyl]phenyl]piperidin-2-one
SMILESO=C(c1ccc(N2CCCCC2=O)cc1)N1CCC(CN2CCOCC2)CC1
InChIInChI=1S/C22H31N3O3/c26-21-3-1-2-10-25(21)20-6-4-19(5-7-20)22(27)24-11-8-18(9-12-24)17-23-13-15-28-16-14-23/h4-7,18H,1-3,8-17H2
InChIKeyFKSCGENQKFDAOW-UHFFFAOYSA-N
MW385.51 g/mol
LogP2.39
Rot. Bonds4

About 1-[4-[4-(morpholin-4-ylmethyl)piperidine-1-carbonyl]phenyl]piperidin-2-one

1-[4-[4-(morpholin-4-ylmethyl)piperidine-1-carbonyl]phenyl]piperidin-2-one (PubChem CID 55748028) has the molecular formula C22H31N3O3 and a molecular weight of 385.51 g/mol. Its IUPAC name is 1-[4-[4-(morpholin-4-ylmethyl)piperidine-1-carbonyl]phenyl]piperidin-2-one.

Molecular Properties

Compound Name1-[4-[4-(morpholin-4-ylmethyl)piperidine-1-carbonyl]phenyl]piperidin-2-one
PubChem CID55748028
Molecular FormulaC22H31N3O3
Molecular Weight385.51 g/mol
Exact Mass385.24
IUPAC Name1-[4-[4-(morpholin-4-ylmethyl)piperidine-1-carbonyl]phenyl]piperidin-2-one
SMILESO=C(c1ccc(N2CCCCC2=O)cc1)N1CCC(CN2CCOCC2)CC1
InChIInChI=1S/C22H31N3O3/c26-21-3-1-2-10-25(21)20-6-4-19(5-7-20)22(27)24-11-8-18(9-12-24)17-23-13-15-28-16-14-23/h4-7,18H,1-3,8-17H2
InChIKeyFKSCGENQKFDAOW-UHFFFAOYSA-N
XLogP2.39
TPSA53.09 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.51
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-[4-[4-(morpholine-4-carbonyl)piperidine-1-carbonyl]phenyl]pyrrolidin-2-one
CID 46564409
1-[4-(4-hydroxypiperidine-1-carbonyl)phenyl]piperidin-2-one
CID 110882060
1-[4-[4-(2-morpholin-4-ylacetyl)piperazine-1-carbonyl]phenyl]pyrrolidin-2-one
CID 43038526
1-[4-(2-oxopiperidin-1-yl)benzoyl]piperidine-4-carboxamide
CID 32978699
[4-[(2,6-dimethylmorpholin-4-yl)methyl]phenyl]-[4-(morpholin-4-ylmethyl)piperidin-1-yl]methanone
CID 55845372
1-[4-[4-(piperidine-1-carbonyl)piperazine-1-carbonyl]phenyl]pyrrolidin-2-one
CID 24610385
1-methyl-4-[4-(morpholin-4-ylmethyl)piperidine-1-carbonyl]pyridin-2-one
CID 75461257
4-[4-(2-oxopiperidin-1-yl)benzoyl]morpholine-2-carboxylic acid
CID 126793187
1-[4-[4-[2-(azepan-1-yl)-2-oxoethyl]piperazine-1-carbonyl]phenyl]pyrrolidin-2-one
CID 27744247
(2,6-dichloro-4-pyridinyl)-[4-(morpholin-4-ylmethyl)piperidin-1-yl]methanone
CID 78902470
1-[4-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-2-carbonyl]phenyl]pyrrolidin-2-one
CID 9296296
(2,3-dimethylquinoxalin-6-yl)-[4-(morpholin-4-ylmethyl)piperidin-1-yl]methanone
CID 110304852

Frequently Asked Questions

What is the IUPAC name of 1-[4-[4-(morpholin-4-ylmethyl)piperidine-1-carbonyl]phenyl]piperidin-2-one?
The IUPAC name of 1-[4-[4-(morpholin-4-ylmethyl)piperidine-1-carbonyl]phenyl]piperidin-2-one (CID 55748028) is 1-[4-[4-(morpholin-4-ylmethyl)piperidine-1-carbonyl]phenyl]piperidin-2-one.
What is the SMILES notation for 1-[4-[4-(morpholin-4-ylmethyl)piperidine-1-carbonyl]phenyl]piperidin-2-one?
The canonical SMILES for 1-[4-[4-(morpholin-4-ylmethyl)piperidine-1-carbonyl]phenyl]piperidin-2-one is O=C(c1ccc(N2CCCCC2=O)cc1)N1CCC(CN2CCOCC2)CC1.
What is the InChIKey of 1-[4-[4-(morpholin-4-ylmethyl)piperidine-1-carbonyl]phenyl]piperidin-2-one?
The InChIKey is FKSCGENQKFDAOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H31N3O3/c26-21-3-1-2-10-25(21)20-6-4-19(5-7-20)22(27)24-11-8-18(9-12-24)17-23-13-15-28-16-14-23/h4-7,18H,1-3,8-17H2.
What are the key properties of 1-[4-[4-(morpholin-4-ylmethyl)piperidine-1-carbonyl]phenyl]piperidin-2-one?
1-[4-[4-(morpholin-4-ylmethyl)piperidine-1-carbonyl]phenyl]piperidin-2-one has a molecular weight of 385.51 g/mol, XLogP of 2.39, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[4-(morpholin-4-ylmethyl)piperidine-1-carbonyl]phenyl]piperidin-2-one is sourced from PubChem (CID 55748028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).