N-[3-(4-hydroxypiperidine-1-carbonyl)phenyl]furan-2-carboxamide

C17H18N2O4 — CID 110897057

IUPACN-[3-(4-hydroxypiperidine-1-carbonyl)phenyl]furan-2-carboxamide
SMILESO=C(Nc1cccc(C(=O)N2CCC(O)CC2)c1)c1ccco1
InChIInChI=1S/C17H18N2O4/c20-14-6-8-19(9-7-14)17(22)12-3-1-4-13(11-12)18-16(21)15-5-2-10-23-15/h1-5,10-11,14,20H,6-9H2,(H,18,21)
InChIKeyMMFOROFLHNICFI-UHFFFAOYSA-N
MW314.34 g/mol
LogP2.13
Rot. Bonds3

About N-[3-(4-hydroxypiperidine-1-carbonyl)phenyl]furan-2-carboxamide

N-[3-(4-hydroxypiperidine-1-carbonyl)phenyl]furan-2-carboxamide (PubChem CID 110897057) has the molecular formula C17H18N2O4 and a molecular weight of 314.34 g/mol. Its IUPAC name is N-[3-(4-hydroxypiperidine-1-carbonyl)phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[3-(4-hydroxypiperidine-1-carbonyl)phenyl]furan-2-carboxamide
PubChem CID110897057
Molecular FormulaC17H18N2O4
Molecular Weight314.34 g/mol
Exact Mass314.13
IUPAC NameN-[3-(4-hydroxypiperidine-1-carbonyl)phenyl]furan-2-carboxamide
SMILESO=C(Nc1cccc(C(=O)N2CCC(O)CC2)c1)c1ccco1
InChIInChI=1S/C17H18N2O4/c20-14-6-8-19(9-7-14)17(22)12-3-1-4-13(11-12)18-16(21)15-5-2-10-23-15/h1-5,10-11,14,20H,6-9H2,(H,18,21)
InChIKeyMMFOROFLHNICFI-UHFFFAOYSA-N
XLogP2.13
TPSA82.78 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.34
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-[[2-[3-(azepane-1-carbonyl)anilino]-2-oxoethyl]amino]phenyl]furan-2-carboxamide
CID 54843452
N-[3-[4-(1,3-benzoxazol-2-yl)piperidine-1-carbonyl]phenyl]furan-2-carboxamide
CID 55821010
N-[3-(2-ethylpiperidine-1-carbonyl)phenyl]furan-2-carboxamide
CID 78793816
N-[3-[2-(methylaminomethyl)pyrrolidine-1-carbonyl]phenyl]furan-2-carboxamide;hydrochloride
CID 119651912
N-[3-[4-[4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)phenyl]piperazine-1-carbonyl]phenyl]furan-2-carboxamide
CID 53064623
N-[3-(4-hydroxypiperidine-1-carbonyl)phenyl]-2,2-dimethylpropanamide
CID 110884052
(3aS,6aR)-2-[3-(furan-2-carbonylamino)benzoyl]-1,3,4,5,6,6a-hexahydrocyclopenta[c]pyrrole-3a-carboxylic acid
CID 120683754
N-[3-[4-(3-pyridin-4-yl-1H-pyrazole-5-carbonyl)piperazine-1-carbonyl]phenyl]furan-2-carboxamide
CID 53087736
N-[3-[4-(furan-2-carbonyl)piperazine-1-carbonyl]phenyl]-2,2-dimethylpropanamide
CID 34471106
N-[3-(4-hydroxypiperidine-1-carbonyl)phenyl]-2,3-dihydro-1H-isoindole-5-carboxamide
CID 167876855
N-[3-cyano-4-(4-hydroxypiperidin-1-yl)phenyl]furan-2-carboxamide
CID 111485570
N-[3-[[2-[4-(piperidine-1-carbonyl)anilino]acetyl]amino]phenyl]furan-2-carboxamide
CID 54841812

Frequently Asked Questions

What is the IUPAC name of N-[3-(4-hydroxypiperidine-1-carbonyl)phenyl]furan-2-carboxamide?
The IUPAC name of N-[3-(4-hydroxypiperidine-1-carbonyl)phenyl]furan-2-carboxamide (CID 110897057) is N-[3-(4-hydroxypiperidine-1-carbonyl)phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[3-(4-hydroxypiperidine-1-carbonyl)phenyl]furan-2-carboxamide?
The canonical SMILES for N-[3-(4-hydroxypiperidine-1-carbonyl)phenyl]furan-2-carboxamide is O=C(Nc1cccc(C(=O)N2CCC(O)CC2)c1)c1ccco1.
What is the InChIKey of N-[3-(4-hydroxypiperidine-1-carbonyl)phenyl]furan-2-carboxamide?
The InChIKey is MMFOROFLHNICFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O4/c20-14-6-8-19(9-7-14)17(22)12-3-1-4-13(11-12)18-16(21)15-5-2-10-23-15/h1-5,10-11,14,20H,6-9H2,(H,18,21).
What are the key properties of N-[3-(4-hydroxypiperidine-1-carbonyl)phenyl]furan-2-carboxamide?
N-[3-(4-hydroxypiperidine-1-carbonyl)phenyl]furan-2-carboxamide has a molecular weight of 314.34 g/mol, XLogP of 2.13, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(4-hydroxypiperidine-1-carbonyl)phenyl]furan-2-carboxamide is sourced from PubChem (CID 110897057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).