N-[2-fluoro-5-(furan-2-yl)phenyl]-3-hydroxypiperidine-1-carboxamide

C16H17FN2O3 — CID 111475551

IUPACN-[2-fluoro-5-(furan-2-yl)phenyl]-3-hydroxypiperidine-1-carboxamide
SMILESO=C(Nc1cc(-c2ccco2)ccc1F)N1CCCC(O)C1
InChIInChI=1S/C16H17FN2O3/c17-13-6-5-11(15-4-2-8-22-15)9-14(13)18-16(21)19-7-1-3-12(20)10-19/h2,4-6,8-9,12,20H,1,3,7,10H2,(H,18,21)
InChIKeyJJAFEFRWZASFQH-UHFFFAOYSA-N
MW304.32 g/mol
LogP3.07
Rot. Bonds2

About N-[2-fluoro-5-(furan-2-yl)phenyl]-3-hydroxypiperidine-1-carboxamide

N-[2-fluoro-5-(furan-2-yl)phenyl]-3-hydroxypiperidine-1-carboxamide (PubChem CID 111475551) has the molecular formula C16H17FN2O3 and a molecular weight of 304.32 g/mol. Its IUPAC name is N-[2-fluoro-5-(furan-2-yl)phenyl]-3-hydroxypiperidine-1-carboxamide.

Molecular Properties

Compound NameN-[2-fluoro-5-(furan-2-yl)phenyl]-3-hydroxypiperidine-1-carboxamide
PubChem CID111475551
Molecular FormulaC16H17FN2O3
Molecular Weight304.32 g/mol
Exact Mass304.12
IUPAC NameN-[2-fluoro-5-(furan-2-yl)phenyl]-3-hydroxypiperidine-1-carboxamide
SMILESO=C(Nc1cc(-c2ccco2)ccc1F)N1CCCC(O)C1
InChIInChI=1S/C16H17FN2O3/c17-13-6-5-11(15-4-2-8-22-15)9-14(13)18-16(21)19-7-1-3-12(20)10-19/h2,4-6,8-9,12,20H,1,3,7,10H2,(H,18,21)
InChIKeyJJAFEFRWZASFQH-UHFFFAOYSA-N
XLogP3.07
TPSA65.71 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.32
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

methyl (3S)-1-[[2-fluoro-4-(furan-2-yl)phenyl]carbamoyl]piperidine-3-carboxylate
CID 125139865
N-(4-chloro-2-fluorophenyl)-3-hydroxypiperidine-1-carboxamide
CID 47032178
N-[4-fluoro-3-[(2-phenylacetyl)amino]phenyl]-3-hydroxypiperidine-1-carboxamide
CID 51118897
N-(2-fluorophenyl)-3-hydroxypyrrolidine-1-carboxamide
CID 62917965
4-fluoro-2-[(3-hydroxypiperidine-1-carbonyl)amino]benzoic acid
CID 61439185
3-hydroxy-4-[(3-hydroxypiperidine-1-carbonyl)amino]benzoic acid
CID 61435039
5-chloro-N-[2-fluoro-5-(furan-2-yl)phenyl]furan-2-carboxamide
CID 100626853
1-[2-fluoro-5-(furan-2-yl)phenyl]-3-(3-hydroxybutyl)urea
CID 111475577
1-[(3,4-difluorophenyl)methyl]-N-[4-(furan-2-yl)phenyl]piperidine-3-carboxamide
CID 162659444
N-(3-chlorophenyl)-3-hydroxypiperidine-1-carboxamide
CID 17392993
N-(5-fluoro-2-phenoxyphenyl)-3-hydroxypiperidine-1-carboxamide
CID 110929977
(3R)-N-(2-fluorophenyl)-3-methylpiperidine-1-carboxamide
CID 41097666

Frequently Asked Questions

What is the IUPAC name of N-[2-fluoro-5-(furan-2-yl)phenyl]-3-hydroxypiperidine-1-carboxamide?
The IUPAC name of N-[2-fluoro-5-(furan-2-yl)phenyl]-3-hydroxypiperidine-1-carboxamide (CID 111475551) is N-[2-fluoro-5-(furan-2-yl)phenyl]-3-hydroxypiperidine-1-carboxamide.
What is the SMILES notation for N-[2-fluoro-5-(furan-2-yl)phenyl]-3-hydroxypiperidine-1-carboxamide?
The canonical SMILES for N-[2-fluoro-5-(furan-2-yl)phenyl]-3-hydroxypiperidine-1-carboxamide is O=C(Nc1cc(-c2ccco2)ccc1F)N1CCCC(O)C1.
What is the InChIKey of N-[2-fluoro-5-(furan-2-yl)phenyl]-3-hydroxypiperidine-1-carboxamide?
The InChIKey is JJAFEFRWZASFQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FN2O3/c17-13-6-5-11(15-4-2-8-22-15)9-14(13)18-16(21)19-7-1-3-12(20)10-19/h2,4-6,8-9,12,20H,1,3,7,10H2,(H,18,21).
What are the key properties of N-[2-fluoro-5-(furan-2-yl)phenyl]-3-hydroxypiperidine-1-carboxamide?
N-[2-fluoro-5-(furan-2-yl)phenyl]-3-hydroxypiperidine-1-carboxamide has a molecular weight of 304.32 g/mol, XLogP of 3.07, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-fluoro-5-(furan-2-yl)phenyl]-3-hydroxypiperidine-1-carboxamide is sourced from PubChem (CID 111475551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).