4-benzoyl-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]piperidine-1-carboxamide

C20H23N3O4 — CID 17461318

IUPAC4-benzoyl-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]piperidine-1-carboxamide
SMILESO=C(CNC(=O)N1CCC(C(=O)c2ccccc2)CC1)NCc1ccco1
InChIInChI=1S/C20H23N3O4/c24-18(21-13-17-7-4-12-27-17)14-22-20(26)23-10-8-16(9-11-23)19(25)15-5-2-1-3-6-15/h1-7,12,16H,8-11,13-14H2,(H,21,24)(H,22,26)
InChIKeyFTHLBSMUGOEJAR-UHFFFAOYSA-N
MW369.42 g/mol
LogP2.20
Rot. Bonds6

About 4-benzoyl-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]piperidine-1-carboxamide

4-benzoyl-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]piperidine-1-carboxamide (PubChem CID 17461318) has the molecular formula C20H23N3O4 and a molecular weight of 369.42 g/mol. Its IUPAC name is 4-benzoyl-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]piperidine-1-carboxamide.

Molecular Properties

Compound Name4-benzoyl-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]piperidine-1-carboxamide
PubChem CID17461318
Molecular FormulaC20H23N3O4
Molecular Weight369.42 g/mol
Exact Mass369.17
IUPAC Name4-benzoyl-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]piperidine-1-carboxamide
SMILESO=C(CNC(=O)N1CCC(C(=O)c2ccccc2)CC1)NCc1ccco1
InChIInChI=1S/C20H23N3O4/c24-18(21-13-17-7-4-12-27-17)14-22-20(26)23-10-8-16(9-11-23)19(25)15-5-2-1-3-6-15/h1-7,12,16H,8-11,13-14H2,(H,21,24)(H,22,26)
InChIKeyFTHLBSMUGOEJAR-UHFFFAOYSA-N
XLogP2.20
TPSA91.65 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.42
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(furan-2-ylmethyl)-2-[4-(4-methylbenzoyl)piperidin-1-yl]acetamide
CID 1437976
2-[4-(cyclopropanecarbonyl)phenyl]sulfanyl-N-(furan-2-ylmethyl)acetamide
CID 94779967
4-N-[cyclopropyl(phenyl)methyl]-1-N-(furan-2-ylmethyl)piperidine-1,4-dicarboxamide
CID 47028581
2-(4-benzoylpiperazin-1-ium-1-yl)-N-(furan-2-ylmethyl)acetamide
CID 9223461
N-(furan-2-ylmethyl)-2-[[N-methyl-C-(4-phenoxypiperidin-1-yl)carbonimidoyl]amino]acetamide;hydroiodide
CID 109426729
N-(furan-2-ylmethyl)-4-(oxolane-2-carbonyl)piperazine-1-carboxamide
CID 86911870
N-(furan-2-ylmethyl)-4-oxo-4-piperidin-1-ylbutanamide
CID 865161
N-(furan-2-ylmethyl)-1-(2-hydroxybenzoyl)piperidine-4-carboxamide
CID 51102513
4-[(3R)-1-(furan-2-ylmethylcarbamoyl)piperidin-3-yl]benzoic acid
CID 97203993
1-(furan-3-carbonyl)-N-(furan-2-ylmethyl)piperidine-4-carboxamide
CID 35550742
3-(azepan-1-yl)-N-(furan-2-ylmethyl)-3-oxopropanamide
CID 108945088
N-benzyl-2-(furan-2-ylmethylamino)acetamide
CID 43084380

Frequently Asked Questions

What is the IUPAC name of 4-benzoyl-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]piperidine-1-carboxamide?
The IUPAC name of 4-benzoyl-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]piperidine-1-carboxamide (CID 17461318) is 4-benzoyl-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]piperidine-1-carboxamide.
What is the SMILES notation for 4-benzoyl-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]piperidine-1-carboxamide?
The canonical SMILES for 4-benzoyl-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]piperidine-1-carboxamide is O=C(CNC(=O)N1CCC(C(=O)c2ccccc2)CC1)NCc1ccco1.
What is the InChIKey of 4-benzoyl-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]piperidine-1-carboxamide?
The InChIKey is FTHLBSMUGOEJAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O4/c24-18(21-13-17-7-4-12-27-17)14-22-20(26)23-10-8-16(9-11-23)19(25)15-5-2-1-3-6-15/h1-7,12,16H,8-11,13-14H2,(H,21,24)(H,22,26).
What are the key properties of 4-benzoyl-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]piperidine-1-carboxamide?
4-benzoyl-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]piperidine-1-carboxamide has a molecular weight of 369.42 g/mol, XLogP of 2.20, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzoyl-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]piperidine-1-carboxamide is sourced from PubChem (CID 17461318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).