1-(3-methylfuran-2-carbonyl)-N-phenylpiperidine-3-carboxamide

C18H20N2O3 — CID 43035253

IUPAC1-(3-methylfuran-2-carbonyl)-N-phenylpiperidine-3-carboxamide
SMILESCc1ccoc1C(=O)N1CCCC(C(=O)Nc2ccccc2)C1
InChIInChI=1S/C18H20N2O3/c1-13-9-11-23-16(13)18(22)20-10-5-6-14(12-20)17(21)19-15-7-3-2-4-8-15/h2-4,7-9,11,14H,5-6,10,12H2,1H3,(H,19,21)
InChIKeyKISLJQZDZYYRLG-UHFFFAOYSA-N
MW312.37 g/mol
LogP3.08
Rot. Bonds3

About 1-(3-methylfuran-2-carbonyl)-N-phenylpiperidine-3-carboxamide

1-(3-methylfuran-2-carbonyl)-N-phenylpiperidine-3-carboxamide (PubChem CID 43035253) has the molecular formula C18H20N2O3 and a molecular weight of 312.37 g/mol. Its IUPAC name is 1-(3-methylfuran-2-carbonyl)-N-phenylpiperidine-3-carboxamide.

Molecular Properties

Compound Name1-(3-methylfuran-2-carbonyl)-N-phenylpiperidine-3-carboxamide
PubChem CID43035253
Molecular FormulaC18H20N2O3
Molecular Weight312.37 g/mol
Exact Mass312.15
IUPAC Name1-(3-methylfuran-2-carbonyl)-N-phenylpiperidine-3-carboxamide
SMILESCc1ccoc1C(=O)N1CCCC(C(=O)Nc2ccccc2)C1
InChIInChI=1S/C18H20N2O3/c1-13-9-11-23-16(13)18(22)20-10-5-6-14(12-20)17(21)19-15-7-3-2-4-8-15/h2-4,7-9,11,14H,5-6,10,12H2,1H3,(H,19,21)
InChIKeyKISLJQZDZYYRLG-UHFFFAOYSA-N
XLogP3.08
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methylbenzoyl)-N-phenylpiperidine-3-carboxamide
CID 17395315
(3S)-3-N-(4-methylphenyl)-1-N-phenylpiperidine-1,3-dicarboxamide
CID 9071786
[1-(3-methylfuran-2-carbonyl)piperidin-3-yl]-morpholin-4-ylmethanone
CID 51329391
(3-chloropiperidin-1-yl)-(3-methylfuran-2-yl)methanone
CID 63393139
1-(6-methylpyridine-3-carbonyl)-N-phenylpiperidine-3-carboxamide
CID 18149048
3-N-phenyl-1-N-propan-2-ylpiperidine-1,3-dicarboxamide
CID 42928143
1-(4-cyanobenzoyl)-N-phenylpiperidine-3-carboxamide
CID 46657993
(3S)-1-(2-anilinobenzoyl)-N-phenylpiperidine-3-carboxamide
CID 27745492
(3R)-1-(2-benzoylbenzoyl)-N-phenylpiperidine-3-carboxamide
CID 26049540
(3-aminopiperidin-1-yl)-(3-methylfuran-2-yl)methanone;hydrochloride
CID 119377765
1-[1-(cyclopropanecarbonyl)piperidine-4-carbonyl]-N-phenylpiperidine-3-carboxamide
CID 46653762
1-[(2R)-2-aminopropanoyl]-N-phenylpiperidine-3-carboxamide
CID 119275697

Frequently Asked Questions

What is the IUPAC name of 1-(3-methylfuran-2-carbonyl)-N-phenylpiperidine-3-carboxamide?
The IUPAC name of 1-(3-methylfuran-2-carbonyl)-N-phenylpiperidine-3-carboxamide (CID 43035253) is 1-(3-methylfuran-2-carbonyl)-N-phenylpiperidine-3-carboxamide.
What is the SMILES notation for 1-(3-methylfuran-2-carbonyl)-N-phenylpiperidine-3-carboxamide?
The canonical SMILES for 1-(3-methylfuran-2-carbonyl)-N-phenylpiperidine-3-carboxamide is Cc1ccoc1C(=O)N1CCCC(C(=O)Nc2ccccc2)C1.
What is the InChIKey of 1-(3-methylfuran-2-carbonyl)-N-phenylpiperidine-3-carboxamide?
The InChIKey is KISLJQZDZYYRLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O3/c1-13-9-11-23-16(13)18(22)20-10-5-6-14(12-20)17(21)19-15-7-3-2-4-8-15/h2-4,7-9,11,14H,5-6,10,12H2,1H3,(H,19,21).
What are the key properties of 1-(3-methylfuran-2-carbonyl)-N-phenylpiperidine-3-carboxamide?
1-(3-methylfuran-2-carbonyl)-N-phenylpiperidine-3-carboxamide has a molecular weight of 312.37 g/mol, XLogP of 3.08, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methylfuran-2-carbonyl)-N-phenylpiperidine-3-carboxamide is sourced from PubChem (CID 43035253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).