N-benzyl-1-(furan-3-carbonyl)-N-methylpiperidine-4-carboxamide

C19H22N2O3 — CID 35552274

IUPACN-benzyl-1-(furan-3-carbonyl)-N-methylpiperidine-4-carboxamide
SMILESCN(Cc1ccccc1)C(=O)C1CCN(C(=O)c2ccoc2)CC1
InChIInChI=1S/C19H22N2O3/c1-20(13-15-5-3-2-4-6-15)18(22)16-7-10-21(11-8-16)19(23)17-9-12-24-14-17/h2-6,9,12,14,16H,7-8,10-11,13H2,1H3
InChIKeyXYCAAAPGDMGGQZ-UHFFFAOYSA-N
MW326.40 g/mol
LogP2.79
Rot. Bonds4

About N-benzyl-1-(furan-3-carbonyl)-N-methylpiperidine-4-carboxamide

N-benzyl-1-(furan-3-carbonyl)-N-methylpiperidine-4-carboxamide (PubChem CID 35552274) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is N-benzyl-1-(furan-3-carbonyl)-N-methylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-benzyl-1-(furan-3-carbonyl)-N-methylpiperidine-4-carboxamide
PubChem CID35552274
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC NameN-benzyl-1-(furan-3-carbonyl)-N-methylpiperidine-4-carboxamide
SMILESCN(Cc1ccccc1)C(=O)C1CCN(C(=O)c2ccoc2)CC1
InChIInChI=1S/C19H22N2O3/c1-20(13-15-5-3-2-4-6-15)18(22)16-7-10-21(11-8-16)19(23)17-9-12-24-14-17/h2-6,9,12,14,16H,7-8,10-11,13H2,1H3
InChIKeyXYCAAAPGDMGGQZ-UHFFFAOYSA-N
XLogP2.79
TPSA53.76 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 52.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(furan-3-carbonyl)-N-(furan-2-ylmethyl)-N-methylpiperidine-4-carboxamide
CID 35699759
N-benzyl-1-(4-chlorobenzoyl)-N-methylpiperidine-4-carboxamide
CID 17119215
1-(furan-3-carbonyl)-N-methyl-N-(2-methylpropyl)piperidine-4-carboxamide
CID 134059017
N-[(5-chlorothiophen-2-yl)methyl]-1-(furan-3-carbonyl)-N-methylpiperidine-4-carboxamide
CID 35706852
N-[[4-(dimethylcarbamoyl)phenyl]methyl]-N-ethyl-1-(furan-3-carbonyl)piperidine-4-carboxamide
CID 56512423
N-cyclopropyl-1-(furan-3-carbonyl)-N-[(4-methoxyphenyl)methyl]piperidine-4-carboxamide
CID 35734927
N-cycloheptyl-1-(furan-3-carbonyl)-N-methylpiperidine-4-carboxamide
CID 134048834
N-ethyl-N-[(3-fluorophenyl)methyl]-1-(furan-3-carbonyl)piperidine-4-carboxamide
CID 134048626
N-benzyl-1-[1-(3-chlorobenzoyl)piperidin-4-yl]-N-methylpiperidine-4-carboxamide
CID 42693664
N-benzyl-1-[1-[3,5-bis(trifluoromethyl)benzoyl]piperidin-4-yl]-N-methylpiperidine-4-carboxamide
CID 42693650
N-(1-benzylpiperidin-3-yl)-1-(furan-3-carbonyl)-N-propylpiperidine-4-carboxamide
CID 51132454
N-benzyl-1-(1H-indole-2-carbonyl)-N-methylpiperidine-4-carboxamide
CID 66571403

Frequently Asked Questions

What is the IUPAC name of N-benzyl-1-(furan-3-carbonyl)-N-methylpiperidine-4-carboxamide?
The IUPAC name of N-benzyl-1-(furan-3-carbonyl)-N-methylpiperidine-4-carboxamide (CID 35552274) is N-benzyl-1-(furan-3-carbonyl)-N-methylpiperidine-4-carboxamide.
What is the SMILES notation for N-benzyl-1-(furan-3-carbonyl)-N-methylpiperidine-4-carboxamide?
The canonical SMILES for N-benzyl-1-(furan-3-carbonyl)-N-methylpiperidine-4-carboxamide is CN(Cc1ccccc1)C(=O)C1CCN(C(=O)c2ccoc2)CC1.
What is the InChIKey of N-benzyl-1-(furan-3-carbonyl)-N-methylpiperidine-4-carboxamide?
The InChIKey is XYCAAAPGDMGGQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-20(13-15-5-3-2-4-6-15)18(22)16-7-10-21(11-8-16)19(23)17-9-12-24-14-17/h2-6,9,12,14,16H,7-8,10-11,13H2,1H3.
What are the key properties of N-benzyl-1-(furan-3-carbonyl)-N-methylpiperidine-4-carboxamide?
N-benzyl-1-(furan-3-carbonyl)-N-methylpiperidine-4-carboxamide has a molecular weight of 326.40 g/mol, XLogP of 2.79, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-1-(furan-3-carbonyl)-N-methylpiperidine-4-carboxamide is sourced from PubChem (CID 35552274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).