4-[1-[1-(cyclopropanecarbonyl)pyrrolidine-2-carbonyl]piperidin-4-yl]morpholin-3-one

C18H27N3O4 — CID 134796383

IUPAC4-[1-[1-(cyclopropanecarbonyl)pyrrolidine-2-carbonyl]piperidin-4-yl]morpholin-3-one
SMILESO=C(C1CCCN1C(=O)C1CC1)N1CCC(N2CCOCC2=O)CC1
InChIInChI=1S/C18H27N3O4/c22-16-12-25-11-10-20(16)14-5-8-19(9-6-14)18(24)15-2-1-7-21(15)17(23)13-3-4-13/h13-15H,1-12H2
InChIKeyHKKCRCFYZZAJOL-UHFFFAOYSA-N
MW349.43 g/mol
LogP0.24
Rot. Bonds3

About 4-[1-[1-(cyclopropanecarbonyl)pyrrolidine-2-carbonyl]piperidin-4-yl]morpholin-3-one

4-[1-[1-(cyclopropanecarbonyl)pyrrolidine-2-carbonyl]piperidin-4-yl]morpholin-3-one (PubChem CID 134796383) has the molecular formula C18H27N3O4 and a molecular weight of 349.43 g/mol. Its IUPAC name is 4-[1-[1-(cyclopropanecarbonyl)pyrrolidine-2-carbonyl]piperidin-4-yl]morpholin-3-one.

Molecular Properties

Compound Name4-[1-[1-(cyclopropanecarbonyl)pyrrolidine-2-carbonyl]piperidin-4-yl]morpholin-3-one
PubChem CID134796383
Molecular FormulaC18H27N3O4
Molecular Weight349.43 g/mol
Exact Mass349.20
IUPAC Name4-[1-[1-(cyclopropanecarbonyl)pyrrolidine-2-carbonyl]piperidin-4-yl]morpholin-3-one
SMILESO=C(C1CCCN1C(=O)C1CC1)N1CCC(N2CCOCC2=O)CC1
InChIInChI=1S/C18H27N3O4/c22-16-12-25-11-10-20(16)14-5-8-19(9-6-14)18(24)15-2-1-7-21(15)17(23)13-3-4-13/h13-15H,1-12H2
InChIKeyHKKCRCFYZZAJOL-UHFFFAOYSA-N
XLogP0.24
TPSA70.16 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.43
LogP ≤ 50.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-[1-[1-(2-Methoxyacetyl)pyrrolidine-2-carbonyl]piperidin-4-yl]morpholin-3-one
CID 134798406
4-[1-[1-(Cyclopentanecarbonyl)pyrrolidine-2-carbonyl]piperidin-4-yl]morpholin-3-one
CID 134796562
N,N-dimethyl-2-[4-(3-oxomorpholin-4-yl)piperidine-1-carbonyl]pyrrolidine-1-carboxamide
CID 134797492
1-(Cyclopropylmethyl)-3-morpholin-4-ylpiperidin-2-one
CID 71687081
1-[1-(3-Methyl-4-morpholin-4-ylpyrrolidin-1-yl)-1-oxopropan-2-yl]piperidin-2-one
CID 72122113
N-[1-(2-methoxyacetyl)-5-(piperazine-1-carbonyl)pyrrolidin-3-yl]-N-(2-morpholin-4-ylethyl)cyclopropanecarboxamide
CID 23820720
N-[1-(2-methoxyacetyl)-5-(piperazine-1-carbonyl)pyrrolidin-3-yl]-2-methyl-N-(2-morpholin-4-ylethyl)propanamide
CID 24046870
1-[1-[2-(Cyclopropylmethoxy)propanoyl]piperidin-4-yl]pyrrolidine-2-carboxamide
CID 53581689
1-[4-[1-(2,2-Dimethylpropanoyl)pyrrolidine-2-carbonyl]piperazin-1-yl]-2-morpholin-4-ylethane-1,2-dione
CID 55607350
2,2-Dimethyl-1-[2-[4-(2-morpholin-4-ylacetyl)piperazine-1-carbonyl]pyrrolidin-1-yl]propan-1-one
CID 55608155
Cyclopropyl-[2-(morpholine-4-carbonyl)pyrrolidin-1-yl]methanone
CID 60707732
2-Methoxy-1-[2-(morpholine-4-carbonyl)pyrrolidin-1-yl]ethanone
CID 63362469

Frequently Asked Questions

What is the IUPAC name of 4-[1-[1-(cyclopropanecarbonyl)pyrrolidine-2-carbonyl]piperidin-4-yl]morpholin-3-one?
The IUPAC name of 4-[1-[1-(cyclopropanecarbonyl)pyrrolidine-2-carbonyl]piperidin-4-yl]morpholin-3-one (CID 134796383) is 4-[1-[1-(cyclopropanecarbonyl)pyrrolidine-2-carbonyl]piperidin-4-yl]morpholin-3-one.
What is the SMILES notation for 4-[1-[1-(cyclopropanecarbonyl)pyrrolidine-2-carbonyl]piperidin-4-yl]morpholin-3-one?
The canonical SMILES for 4-[1-[1-(cyclopropanecarbonyl)pyrrolidine-2-carbonyl]piperidin-4-yl]morpholin-3-one is O=C(C1CCCN1C(=O)C1CC1)N1CCC(N2CCOCC2=O)CC1.
What is the InChIKey of 4-[1-[1-(cyclopropanecarbonyl)pyrrolidine-2-carbonyl]piperidin-4-yl]morpholin-3-one?
The InChIKey is HKKCRCFYZZAJOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N3O4/c22-16-12-25-11-10-20(16)14-5-8-19(9-6-14)18(24)15-2-1-7-21(15)17(23)13-3-4-13/h13-15H,1-12H2.
What are the key properties of 4-[1-[1-(cyclopropanecarbonyl)pyrrolidine-2-carbonyl]piperidin-4-yl]morpholin-3-one?
4-[1-[1-(cyclopropanecarbonyl)pyrrolidine-2-carbonyl]piperidin-4-yl]morpholin-3-one has a molecular weight of 349.43 g/mol, XLogP of 0.24, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-[1-(cyclopropanecarbonyl)pyrrolidine-2-carbonyl]piperidin-4-yl]morpholin-3-one is sourced from PubChem (CID 134796383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).