N-[3-(2-ethylpiperidine-1-carbonyl)phenyl]furan-2-carboxamide

C19H22N2O3 — CID 78793816

IUPACN-[3-(2-ethylpiperidine-1-carbonyl)phenyl]furan-2-carboxamide
SMILESCCC1CCCCN1C(=O)c1cccc(NC(=O)c2ccco2)c1
InChIInChI=1S/C19H22N2O3/c1-2-16-9-3-4-11-21(16)19(23)14-7-5-8-15(13-14)20-18(22)17-10-6-12-24-17/h5-8,10,12-13,16H,2-4,9,11H2,1H3,(H,20,22)
InChIKeyOPQUSNYUTIXXSH-UHFFFAOYSA-N
MW326.40 g/mol
LogP3.94
Rot. Bonds4

About N-[3-(2-ethylpiperidine-1-carbonyl)phenyl]furan-2-carboxamide

N-[3-(2-ethylpiperidine-1-carbonyl)phenyl]furan-2-carboxamide (PubChem CID 78793816) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is N-[3-(2-ethylpiperidine-1-carbonyl)phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[3-(2-ethylpiperidine-1-carbonyl)phenyl]furan-2-carboxamide
PubChem CID78793816
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC NameN-[3-(2-ethylpiperidine-1-carbonyl)phenyl]furan-2-carboxamide
SMILESCCC1CCCCN1C(=O)c1cccc(NC(=O)c2ccco2)c1
InChIInChI=1S/C19H22N2O3/c1-2-16-9-3-4-11-21(16)19(23)14-7-5-8-15(13-14)20-18(22)17-10-6-12-24-17/h5-8,10,12-13,16H,2-4,9,11H2,1H3,(H,20,22)
InChIKeyOPQUSNYUTIXXSH-UHFFFAOYSA-N
XLogP3.94
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-[2-(methylaminomethyl)pyrrolidine-1-carbonyl]phenyl]furan-2-carboxamide;hydrochloride
CID 119651912
N-(3-acetylphenyl)-3-(2-ethylpiperidine-1-carbonyl)benzamide
CID 109056486
N-[3-(4-hydroxypiperidine-1-carbonyl)phenyl]furan-2-carboxamide
CID 110897057
N-[3-(2-ethylpiperidine-1-carbonyl)phenyl]methanesulfonamide
CID 51160926
N-(3,4-dimethoxyphenyl)-3-(2-ethylpiperidine-1-carbonyl)benzamide
CID 109056485
N-[3-(2-ethylpiperidine-1-carbonyl)phenyl]propane-1-sulfonamide
CID 134019044
N-[3-[[2-[3-(azepane-1-carbonyl)anilino]-2-oxoethyl]amino]phenyl]furan-2-carboxamide
CID 54843452
N-(3-acetamidophenyl)-5-(2-ethylpiperidine-1-carbonyl)pyridine-3-carboxamide
CID 109107464
N-[3-(2,3-dimethylpiperazine-1-carbonyl)phenyl]furan-2-carboxamide;hydrochloride
CID 120570517
(3aS,6aR)-2-[3-(furan-2-carbonylamino)benzoyl]-1,3,4,5,6,6a-hexahydrocyclopenta[c]pyrrole-3a-carboxylic acid
CID 120683754
(3-chlorophenyl)-[(2R)-2-ethylpiperidin-1-yl]methanone
CID 1206104
3-(2-ethylpiperidine-1-carbonyl)-N-propylbenzamide
CID 109050358

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-ethylpiperidine-1-carbonyl)phenyl]furan-2-carboxamide?
The IUPAC name of N-[3-(2-ethylpiperidine-1-carbonyl)phenyl]furan-2-carboxamide (CID 78793816) is N-[3-(2-ethylpiperidine-1-carbonyl)phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[3-(2-ethylpiperidine-1-carbonyl)phenyl]furan-2-carboxamide?
The canonical SMILES for N-[3-(2-ethylpiperidine-1-carbonyl)phenyl]furan-2-carboxamide is CCC1CCCCN1C(=O)c1cccc(NC(=O)c2ccco2)c1.
What is the InChIKey of N-[3-(2-ethylpiperidine-1-carbonyl)phenyl]furan-2-carboxamide?
The InChIKey is OPQUSNYUTIXXSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-2-16-9-3-4-11-21(16)19(23)14-7-5-8-15(13-14)20-18(22)17-10-6-12-24-17/h5-8,10,12-13,16H,2-4,9,11H2,1H3,(H,20,22).
What are the key properties of N-[3-(2-ethylpiperidine-1-carbonyl)phenyl]furan-2-carboxamide?
N-[3-(2-ethylpiperidine-1-carbonyl)phenyl]furan-2-carboxamide has a molecular weight of 326.40 g/mol, XLogP of 3.94, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-ethylpiperidine-1-carbonyl)phenyl]furan-2-carboxamide is sourced from PubChem (CID 78793816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).