1-benzyl-N-(furan-2-ylmethyl)piperidine-3-carboxamide

C18H22N2O2 — CID 43921227

IUPAC1-benzyl-N-(furan-2-ylmethyl)piperidine-3-carboxamide
SMILESO=C(NCc1ccco1)C1CCCN(Cc2ccccc2)C1
InChIInChI=1S/C18H22N2O2/c21-18(19-12-17-9-5-11-22-17)16-8-4-10-20(14-16)13-15-6-2-1-3-7-15/h1-3,5-7,9,11,16H,4,8,10,12-14H2,(H,19,21)
InChIKeyRMTPFTMJDLLYBO-UHFFFAOYSA-N
MW298.39 g/mol
LogP2.81
Rot. Bonds5

About 1-benzyl-N-(furan-2-ylmethyl)piperidine-3-carboxamide

1-benzyl-N-(furan-2-ylmethyl)piperidine-3-carboxamide (PubChem CID 43921227) has the molecular formula C18H22N2O2 and a molecular weight of 298.39 g/mol. Its IUPAC name is 1-benzyl-N-(furan-2-ylmethyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name1-benzyl-N-(furan-2-ylmethyl)piperidine-3-carboxamide
PubChem CID43921227
Molecular FormulaC18H22N2O2
Molecular Weight298.39 g/mol
Exact Mass298.17
IUPAC Name1-benzyl-N-(furan-2-ylmethyl)piperidine-3-carboxamide
SMILESO=C(NCc1ccco1)C1CCCN(Cc2ccccc2)C1
InChIInChI=1S/C18H22N2O2/c21-18(19-12-17-9-5-11-22-17)16-8-4-10-20(14-16)13-15-6-2-1-3-7-15/h1-3,5-7,9,11,16H,4,8,10,12-14H2,(H,19,21)
InChIKeyRMTPFTMJDLLYBO-UHFFFAOYSA-N
XLogP2.81
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,1-dibenzylpiperidine-3-carboxamide
CID 43918745
4-[[[(3R)-1-benzylpiperidine-3-carbonyl]amino]methyl]benzoic acid
CID 124703905
(3R)-N-[(5-chlorothiophen-2-yl)methyl]-1-(furan-2-ylmethyl)piperidine-3-carboxamide
CID 97210781
1-benzyl-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]piperidine-3-carboxamide
CID 43917296
(3S)-3-N-(furan-2-ylmethyl)-1-N-phenylpiperidine-1,3-dicarboxamide
CID 7435298
1-(1-benzyl-6-oxopyridazin-4-yl)-N-(furan-2-ylmethyl)piperidine-3-carboxamide
CID 53204075
1-benzyl-N-methylpiperidine-3-carboxamide
CID 43918327
(3R)-1-benzyl-N-prop-2-enylpiperidine-3-carboxamide
CID 93490114
1-(furan-2-ylmethyl)-N-[(3-pyrazol-1-ylphenyl)methyl]piperidine-3-carboxamide
CID 72886430
1-benzyl-N-(1H-pyrazol-5-ylmethyl)piperidine-3-carboxamide
CID 47072465
1-[(3-chlorophenyl)methyl]-N-(furan-2-ylmethyl)piperidine-4-carboxamide
CID 25249201
(3R)-N-[(5-ethyl-1,3,4-thiadiazol-2-yl)methyl]-1-(furan-2-ylmethyl)piperidine-3-carboxamide
CID 97284250

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-N-(furan-2-ylmethyl)piperidine-3-carboxamide?
The IUPAC name of 1-benzyl-N-(furan-2-ylmethyl)piperidine-3-carboxamide (CID 43921227) is 1-benzyl-N-(furan-2-ylmethyl)piperidine-3-carboxamide.
What is the SMILES notation for 1-benzyl-N-(furan-2-ylmethyl)piperidine-3-carboxamide?
The canonical SMILES for 1-benzyl-N-(furan-2-ylmethyl)piperidine-3-carboxamide is O=C(NCc1ccco1)C1CCCN(Cc2ccccc2)C1.
What is the InChIKey of 1-benzyl-N-(furan-2-ylmethyl)piperidine-3-carboxamide?
The InChIKey is RMTPFTMJDLLYBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O2/c21-18(19-12-17-9-5-11-22-17)16-8-4-10-20(14-16)13-15-6-2-1-3-7-15/h1-3,5-7,9,11,16H,4,8,10,12-14H2,(H,19,21).
What are the key properties of 1-benzyl-N-(furan-2-ylmethyl)piperidine-3-carboxamide?
1-benzyl-N-(furan-2-ylmethyl)piperidine-3-carboxamide has a molecular weight of 298.39 g/mol, XLogP of 2.81, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-N-(furan-2-ylmethyl)piperidine-3-carboxamide is sourced from PubChem (CID 43921227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).