N-[2-oxo-2-[(6-oxopiperidin-3-yl)amino]ethyl]furan-2-carboxamide

C12H15N3O4 — CID 55211401

IUPACN-[2-oxo-2-[(6-oxopiperidin-3-yl)amino]ethyl]furan-2-carboxamide
SMILESO=C1CCC(NC(=O)CNC(=O)c2ccco2)CN1
InChIInChI=1S/C12H15N3O4/c16-10-4-3-8(6-13-10)15-11(17)7-14-12(18)9-2-1-5-19-9/h1-2,5,8H,3-4,6-7H2,(H,13,16)(H,14,18)(H,15,17)
InChIKeyINDXGOHWEHQZOL-UHFFFAOYSA-N
MW265.27 g/mol
LogP-0.60
Rot. Bonds4

About N-[2-oxo-2-[(6-oxopiperidin-3-yl)amino]ethyl]furan-2-carboxamide

N-[2-oxo-2-[(6-oxopiperidin-3-yl)amino]ethyl]furan-2-carboxamide (PubChem CID 55211401) has the molecular formula C12H15N3O4 and a molecular weight of 265.27 g/mol. Its IUPAC name is N-[2-oxo-2-[(6-oxopiperidin-3-yl)amino]ethyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-oxo-2-[(6-oxopiperidin-3-yl)amino]ethyl]furan-2-carboxamide
PubChem CID55211401
Molecular FormulaC12H15N3O4
Molecular Weight265.27 g/mol
Exact Mass265.11
IUPAC NameN-[2-oxo-2-[(6-oxopiperidin-3-yl)amino]ethyl]furan-2-carboxamide
SMILESO=C1CCC(NC(=O)CNC(=O)c2ccco2)CN1
InChIInChI=1S/C12H15N3O4/c16-10-4-3-8(6-13-10)15-11(17)7-14-12(18)9-2-1-5-19-9/h1-2,5,8H,3-4,6-7H2,(H,13,16)(H,14,18)(H,15,17)
InChIKeyINDXGOHWEHQZOL-UHFFFAOYSA-N
XLogP-0.60
TPSA100.44 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.27
LogP ≤ 5-0.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-methyl-N-[2-oxo-2-[(6-oxopiperidin-3-yl)amino]ethyl]benzamide
CID 63373381
3-methyl-N-[2-oxo-2-[(6-oxopiperidin-3-yl)amino]ethyl]benzamide
CID 63373773
N-[2-[[(2R,4aR,8aS)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl]amino]-2-oxoethyl]furan-2-carboxamide
CID 124785873
2-anilino-N-(6-oxopiperidin-3-yl)acetamide
CID 63663554
N-(6-oxopiperidin-3-yl)-2-pyridin-3-ylacetamide
CID 63661195
N-[3-oxo-3-(pyrrolidin-3-ylamino)propyl]furan-2-carboxamide;hydrochloride
CID 119450150
N-[2-[[(1S,2S)-2-methylcyclohexyl]amino]-2-oxoethyl]furan-2-carboxamide
CID 9404333
N-(6-oxopiperidin-3-yl)-2-(prop-2-enylamino)acetamide
CID 79280048
N-[2-(1-azabicyclo[2.2.2]octan-3-ylamino)-2-oxoethyl]furan-2-carboxamide
CID 91948672
5-(furan-2-yl)-N-(6-oxopiperidin-3-yl)-1,2-oxazole-3-carboxamide
CID 62491594
2-(2-fluorophenyl)-N-(6-oxopiperidin-3-yl)acetamide
CID 62490622
[2-(cyclohexylamino)-2-oxoethyl] 2-(furan-2-carbonylamino)acetate
CID 7880332

Frequently Asked Questions

What is the IUPAC name of N-[2-oxo-2-[(6-oxopiperidin-3-yl)amino]ethyl]furan-2-carboxamide?
The IUPAC name of N-[2-oxo-2-[(6-oxopiperidin-3-yl)amino]ethyl]furan-2-carboxamide (CID 55211401) is N-[2-oxo-2-[(6-oxopiperidin-3-yl)amino]ethyl]furan-2-carboxamide.
What is the SMILES notation for N-[2-oxo-2-[(6-oxopiperidin-3-yl)amino]ethyl]furan-2-carboxamide?
The canonical SMILES for N-[2-oxo-2-[(6-oxopiperidin-3-yl)amino]ethyl]furan-2-carboxamide is O=C1CCC(NC(=O)CNC(=O)c2ccco2)CN1.
What is the InChIKey of N-[2-oxo-2-[(6-oxopiperidin-3-yl)amino]ethyl]furan-2-carboxamide?
The InChIKey is INDXGOHWEHQZOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O4/c16-10-4-3-8(6-13-10)15-11(17)7-14-12(18)9-2-1-5-19-9/h1-2,5,8H,3-4,6-7H2,(H,13,16)(H,14,18)(H,15,17).
What are the key properties of N-[2-oxo-2-[(6-oxopiperidin-3-yl)amino]ethyl]furan-2-carboxamide?
N-[2-oxo-2-[(6-oxopiperidin-3-yl)amino]ethyl]furan-2-carboxamide has a molecular weight of 265.27 g/mol, XLogP of -0.60, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-oxo-2-[(6-oxopiperidin-3-yl)amino]ethyl]furan-2-carboxamide is sourced from PubChem (CID 55211401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).