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

C14H13ClFNO2 — CID 47168787

IUPAC5-chloro-2-fluoro-N-[1-(furan-2-yl)propan-2-yl]benzamide
SMILESCC(Cc1ccco1)NC(=O)c1cc(Cl)ccc1F
InChIInChI=1S/C14H13ClFNO2/c1-9(7-11-3-2-6-19-11)17-14(18)12-8-10(15)4-5-13(12)16/h2-6,8-9H,7H2,1H3,(H,17,18)
InChIKeyYHQOKKCKSSJDLH-UHFFFAOYSA-N
MW281.71 g/mol
LogP3.43
Rot. Bonds4

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

5-chloro-2-fluoro-N-[1-(furan-2-yl)propan-2-yl]benzamide (PubChem CID 47168787) has the molecular formula C14H13ClFNO2 and a molecular weight of 281.71 g/mol. Its IUPAC name is 5-chloro-2-fluoro-N-[1-(furan-2-yl)propan-2-yl]benzamide.

Molecular Properties

Compound Name5-chloro-2-fluoro-N-[1-(furan-2-yl)propan-2-yl]benzamide
PubChem CID47168787
Molecular FormulaC14H13ClFNO2
Molecular Weight281.71 g/mol
Exact Mass281.06
IUPAC Name5-chloro-2-fluoro-N-[1-(furan-2-yl)propan-2-yl]benzamide
SMILESCC(Cc1ccco1)NC(=O)c1cc(Cl)ccc1F
InChIInChI=1S/C14H13ClFNO2/c1-9(7-11-3-2-6-19-11)17-14(18)12-8-10(15)4-5-13(12)16/h2-6,8-9H,7H2,1H3,(H,17,18)
InChIKeyYHQOKKCKSSJDLH-UHFFFAOYSA-N
XLogP3.43
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.71
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-chloro-N-[1-(furan-2-yl)propan-2-yl]-2-hydroxybenzamide
CID 47168819
5-chloro-2-(ethylamino)-N-[1-(furan-2-yl)propan-2-yl]benzamide
CID 62179264
5-chloro-2-fluoro-N-[(2R)-1-(furan-2-ylmethylamino)-1-oxopropan-2-yl]benzamide
CID 94811176
2-fluoro-N-[(2S)-1-(furan-2-yl)propan-2-yl]-5-(2-oxoimidazolidin-1-yl)benzamide
CID 97215145
5-chloro-2-fluoro-N-(4-methylpentan-2-yl)benzamide
CID 61146087
1-(4-chlorophenyl)-3-[1-(furan-2-yl)propan-2-yl]urea
CID 47171952
N-[(2R)-1-aminopropan-2-yl]-5-chloro-2-fluorobenzamide
CID 104873078
2-[(4-chlorophenyl)sulfonylamino]-N-[1-(furan-2-yl)propan-2-yl]benzamide
CID 55620142
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
2-(ethylamino)-N-[1-(furan-2-yl)propan-2-yl]benzamide
CID 62179091

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-fluoro-N-[1-(furan-2-yl)propan-2-yl]benzamide?
The IUPAC name of 5-chloro-2-fluoro-N-[1-(furan-2-yl)propan-2-yl]benzamide (CID 47168787) is 5-chloro-2-fluoro-N-[1-(furan-2-yl)propan-2-yl]benzamide.
What is the SMILES notation for 5-chloro-2-fluoro-N-[1-(furan-2-yl)propan-2-yl]benzamide?
The canonical SMILES for 5-chloro-2-fluoro-N-[1-(furan-2-yl)propan-2-yl]benzamide is CC(Cc1ccco1)NC(=O)c1cc(Cl)ccc1F.
What is the InChIKey of 5-chloro-2-fluoro-N-[1-(furan-2-yl)propan-2-yl]benzamide?
The InChIKey is YHQOKKCKSSJDLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClFNO2/c1-9(7-11-3-2-6-19-11)17-14(18)12-8-10(15)4-5-13(12)16/h2-6,8-9H,7H2,1H3,(H,17,18).
What are the key properties of 5-chloro-2-fluoro-N-[1-(furan-2-yl)propan-2-yl]benzamide?
5-chloro-2-fluoro-N-[1-(furan-2-yl)propan-2-yl]benzamide has a molecular weight of 281.71 g/mol, XLogP of 3.43, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-fluoro-N-[1-(furan-2-yl)propan-2-yl]benzamide is sourced from PubChem (CID 47168787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).