4-N-[1-(furan-2-yl)ethyl]-1-N-phenylpiperidine-1,4-dicarboxamide

C19H23N3O3 — CID 47008803

IUPAC4-N-[1-(furan-2-yl)ethyl]-1-N-phenylpiperidine-1,4-dicarboxamide
SMILESCC(NC(=O)C1CCN(C(=O)Nc2ccccc2)CC1)c1ccco1
InChIInChI=1S/C19H23N3O3/c1-14(17-8-5-13-25-17)20-18(23)15-9-11-22(12-10-15)19(24)21-16-6-3-2-4-7-16/h2-8,13-15H,9-12H2,1H3,(H,20,23)(H,21,24)
InChIKeyBJTONIWYRDBNMH-UHFFFAOYSA-N
MW341.41 g/mol
LogP3.40
Rot. Bonds4

About 4-N-[1-(furan-2-yl)ethyl]-1-N-phenylpiperidine-1,4-dicarboxamide

4-N-[1-(furan-2-yl)ethyl]-1-N-phenylpiperidine-1,4-dicarboxamide (PubChem CID 47008803) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is 4-N-[1-(furan-2-yl)ethyl]-1-N-phenylpiperidine-1,4-dicarboxamide.

Molecular Properties

Compound Name4-N-[1-(furan-2-yl)ethyl]-1-N-phenylpiperidine-1,4-dicarboxamide
PubChem CID47008803
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC Name4-N-[1-(furan-2-yl)ethyl]-1-N-phenylpiperidine-1,4-dicarboxamide
SMILESCC(NC(=O)C1CCN(C(=O)Nc2ccccc2)CC1)c1ccco1
InChIInChI=1S/C19H23N3O3/c1-14(17-8-5-13-25-17)20-18(23)15-9-11-22(12-10-15)19(24)21-16-6-3-2-4-7-16/h2-8,13-15H,9-12H2,1H3,(H,20,23)(H,21,24)
InChIKeyBJTONIWYRDBNMH-UHFFFAOYSA-N
XLogP3.40
TPSA74.58 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-N-(1-naphthalen-1-ylethyl)-1-N-phenylpiperidine-1,4-dicarboxamide
CID 42907490
4-N-[(1R)-2-methyl-1-thiophen-2-ylpropyl]-1-N-phenylpiperidine-1,4-dicarboxamide
CID 26462883
4-N-[(1S)-1-(2,4-difluorophenyl)ethyl]-1-N-phenylpiperidine-1,4-dicarboxamide
CID 26753076
4-N-[(1R)-1-(2,4-difluorophenyl)ethyl]-1-N-phenylpiperidine-1,4-dicarboxamide
CID 26753074
4-N-(6-methylheptan-2-yl)-1-N-phenylpiperidine-1,4-dicarboxamide
CID 51158606
1-N-phenyl-4-N-(2-propan-2-ylpyrazol-3-yl)piperidine-1,4-dicarboxamide
CID 78772201
N-[1-(furan-2-yl)ethyl]piperidine-4-carboxamide
CID 43535349
4-N-[cyclopropyl-(4-methylphenyl)methyl]-1-N-phenylpiperidine-1,4-dicarboxamide
CID 55478446
4-N-(2-methylpropyl)-1-N-[4-(phenylcarbamoylamino)phenyl]piperidine-1,4-dicarboxamide
CID 50845707
1-(phenylcarbamoyl)piperidine-4-carboxylate
CID 2113074
1-N-phenyl-4-N-[4-(5-propan-2-yl-1,3-oxazol-2-yl)phenyl]piperidine-1,4-dicarboxamide
CID 86964171
4-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]-N-phenylpiperidine-1-carboxamide
CID 17474266

Frequently Asked Questions

What is the IUPAC name of 4-N-[1-(furan-2-yl)ethyl]-1-N-phenylpiperidine-1,4-dicarboxamide?
The IUPAC name of 4-N-[1-(furan-2-yl)ethyl]-1-N-phenylpiperidine-1,4-dicarboxamide (CID 47008803) is 4-N-[1-(furan-2-yl)ethyl]-1-N-phenylpiperidine-1,4-dicarboxamide.
What is the SMILES notation for 4-N-[1-(furan-2-yl)ethyl]-1-N-phenylpiperidine-1,4-dicarboxamide?
The canonical SMILES for 4-N-[1-(furan-2-yl)ethyl]-1-N-phenylpiperidine-1,4-dicarboxamide is CC(NC(=O)C1CCN(C(=O)Nc2ccccc2)CC1)c1ccco1.
What is the InChIKey of 4-N-[1-(furan-2-yl)ethyl]-1-N-phenylpiperidine-1,4-dicarboxamide?
The InChIKey is BJTONIWYRDBNMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-14(17-8-5-13-25-17)20-18(23)15-9-11-22(12-10-15)19(24)21-16-6-3-2-4-7-16/h2-8,13-15H,9-12H2,1H3,(H,20,23)(H,21,24).
What are the key properties of 4-N-[1-(furan-2-yl)ethyl]-1-N-phenylpiperidine-1,4-dicarboxamide?
4-N-[1-(furan-2-yl)ethyl]-1-N-phenylpiperidine-1,4-dicarboxamide has a molecular weight of 341.41 g/mol, XLogP of 3.40, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-[1-(furan-2-yl)ethyl]-1-N-phenylpiperidine-1,4-dicarboxamide is sourced from PubChem (CID 47008803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).