N-ethyl-1-(furan-3-carbonyl)-N-phenylpiperidine-3-carboxamide

C19H22N2O3 — CID 43054894

IUPACN-ethyl-1-(furan-3-carbonyl)-N-phenylpiperidine-3-carboxamide
SMILESCCN(C(=O)C1CCCN(C(=O)c2ccoc2)C1)c1ccccc1
InChIInChI=1S/C19H22N2O3/c1-2-21(17-8-4-3-5-9-17)19(23)15-7-6-11-20(13-15)18(22)16-10-12-24-14-16/h3-5,8-10,12,14-15H,2,6-7,11,13H2,1H3
InChIKeyZFMQFXJUEZMODZ-UHFFFAOYSA-N
MW326.40 g/mol
LogP3.18
Rot. Bonds4

About N-ethyl-1-(furan-3-carbonyl)-N-phenylpiperidine-3-carboxamide

N-ethyl-1-(furan-3-carbonyl)-N-phenylpiperidine-3-carboxamide (PubChem CID 43054894) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is N-ethyl-1-(furan-3-carbonyl)-N-phenylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-1-(furan-3-carbonyl)-N-phenylpiperidine-3-carboxamide
PubChem CID43054894
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC NameN-ethyl-1-(furan-3-carbonyl)-N-phenylpiperidine-3-carboxamide
SMILESCCN(C(=O)C1CCCN(C(=O)c2ccoc2)C1)c1ccccc1
InChIInChI=1S/C19H22N2O3/c1-2-21(17-8-4-3-5-9-17)19(23)15-7-6-11-20(13-15)18(22)16-10-12-24-14-16/h3-5,8-10,12,14-15H,2,6-7,11,13H2,1H3
InChIKeyZFMQFXJUEZMODZ-UHFFFAOYSA-N
XLogP3.18
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 ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(furan-3-carbonyl)-N-phenylpiperidine-3-carboxamide?
The IUPAC name of N-ethyl-1-(furan-3-carbonyl)-N-phenylpiperidine-3-carboxamide (CID 43054894) is N-ethyl-1-(furan-3-carbonyl)-N-phenylpiperidine-3-carboxamide.
What is the SMILES notation for N-ethyl-1-(furan-3-carbonyl)-N-phenylpiperidine-3-carboxamide?
The canonical SMILES for N-ethyl-1-(furan-3-carbonyl)-N-phenylpiperidine-3-carboxamide is CCN(C(=O)C1CCCN(C(=O)c2ccoc2)C1)c1ccccc1.
What is the InChIKey of N-ethyl-1-(furan-3-carbonyl)-N-phenylpiperidine-3-carboxamide?
The InChIKey is ZFMQFXJUEZMODZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-2-21(17-8-4-3-5-9-17)19(23)15-7-6-11-20(13-15)18(22)16-10-12-24-14-16/h3-5,8-10,12,14-15H,2,6-7,11,13H2,1H3.
What are the key properties of N-ethyl-1-(furan-3-carbonyl)-N-phenylpiperidine-3-carboxamide?
N-ethyl-1-(furan-3-carbonyl)-N-phenylpiperidine-3-carboxamide has a molecular weight of 326.40 g/mol, XLogP of 3.18, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(furan-3-carbonyl)-N-phenylpiperidine-3-carboxamide is sourced from PubChem (CID 43054894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).