5-chloro-N-[1-(furan-2-yl)propan-2-yl]-2-hydroxybenzamide

C14H14ClNO3 — CID 47168819

IUPAC5-chloro-N-[1-(furan-2-yl)propan-2-yl]-2-hydroxybenzamide
SMILESCC(Cc1ccco1)NC(=O)c1cc(Cl)ccc1O
InChIInChI=1S/C14H14ClNO3/c1-9(7-11-3-2-6-19-11)16-14(18)12-8-10(15)4-5-13(12)17/h2-6,8-9,17H,7H2,1H3,(H,16,18)
InChIKeyJBPOFZOAXIWGAM-UHFFFAOYSA-N
MW279.72 g/mol
LogP3.00
Rot. Bonds4

About 5-chloro-N-[1-(furan-2-yl)propan-2-yl]-2-hydroxybenzamide

5-chloro-N-[1-(furan-2-yl)propan-2-yl]-2-hydroxybenzamide (PubChem CID 47168819) has the molecular formula C14H14ClNO3 and a molecular weight of 279.72 g/mol. Its IUPAC name is 5-chloro-N-[1-(furan-2-yl)propan-2-yl]-2-hydroxybenzamide.

Molecular Properties

Compound Name5-chloro-N-[1-(furan-2-yl)propan-2-yl]-2-hydroxybenzamide
PubChem CID47168819
Molecular FormulaC14H14ClNO3
Molecular Weight279.72 g/mol
Exact Mass279.07
IUPAC Name5-chloro-N-[1-(furan-2-yl)propan-2-yl]-2-hydroxybenzamide
SMILESCC(Cc1ccco1)NC(=O)c1cc(Cl)ccc1O
InChIInChI=1S/C14H14ClNO3/c1-9(7-11-3-2-6-19-11)16-14(18)12-8-10(15)4-5-13(12)17/h2-6,8-9,17H,7H2,1H3,(H,16,18)
InChIKeyJBPOFZOAXIWGAM-UHFFFAOYSA-N
XLogP3.00
TPSA62.47 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.72
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-2-fluoro-N-[1-(furan-2-yl)propan-2-yl]benzamide
CID 47168787
5-chloro-2-(ethylamino)-N-[1-(furan-2-yl)propan-2-yl]benzamide
CID 62179264
5-chloro-N-(1-chloropropan-2-yl)-2-hydroxybenzamide
CID 114299358
1-(4-chlorophenyl)-3-[1-(furan-2-yl)propan-2-yl]urea
CID 47171952
2-[(4-chlorophenyl)sulfonylamino]-N-[1-(furan-2-yl)propan-2-yl]benzamide
CID 55620142
2-chloro-N-[1-(furan-2-yl)propan-2-yl]-6-methylpyridine-4-carboxamide
CID 113378355
2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-N-[(2S)-1-(furan-2-yl)propan-2-yl]benzamide
CID 92865777
N-[1-(furan-2-yl)propan-2-yl]benzamide
CID 47148390
4-bromo-N-[1-(furan-2-yl)propan-2-yl]-2-sulfanylbenzamide
CID 107025104
5-chloro-2-hydroxy-N-(4-methylsulfinylbutan-2-yl)benzamide
CID 113248423
2-(ethylamino)-N-[1-(furan-2-yl)propan-2-yl]benzamide
CID 62179091
N-[(2S)-1-(furan-2-yl)propan-2-yl]-2-oxo-1H-pyridine-3-carboxamide
CID 94022833

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[1-(furan-2-yl)propan-2-yl]-2-hydroxybenzamide?
The IUPAC name of 5-chloro-N-[1-(furan-2-yl)propan-2-yl]-2-hydroxybenzamide (CID 47168819) is 5-chloro-N-[1-(furan-2-yl)propan-2-yl]-2-hydroxybenzamide.
What is the SMILES notation for 5-chloro-N-[1-(furan-2-yl)propan-2-yl]-2-hydroxybenzamide?
The canonical SMILES for 5-chloro-N-[1-(furan-2-yl)propan-2-yl]-2-hydroxybenzamide is CC(Cc1ccco1)NC(=O)c1cc(Cl)ccc1O.
What is the InChIKey of 5-chloro-N-[1-(furan-2-yl)propan-2-yl]-2-hydroxybenzamide?
The InChIKey is JBPOFZOAXIWGAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClNO3/c1-9(7-11-3-2-6-19-11)16-14(18)12-8-10(15)4-5-13(12)17/h2-6,8-9,17H,7H2,1H3,(H,16,18).
What are the key properties of 5-chloro-N-[1-(furan-2-yl)propan-2-yl]-2-hydroxybenzamide?
5-chloro-N-[1-(furan-2-yl)propan-2-yl]-2-hydroxybenzamide has a molecular weight of 279.72 g/mol, XLogP of 3.00, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[1-(furan-2-yl)propan-2-yl]-2-hydroxybenzamide is sourced from PubChem (CID 47168819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).