2,6-dichloro-N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide

C14H13Cl2NO3 — CID 71975267

IUPAC2,6-dichloro-N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide
SMILESCC(O)(CNC(=O)c1c(Cl)cccc1Cl)c1ccco1
InChIInChI=1S/C14H13Cl2NO3/c1-14(19,11-6-3-7-20-11)8-17-13(18)12-9(15)4-2-5-10(12)16/h2-7,19H,8H2,1H3,(H,17,18)
InChIKeyIEPVEOWZGVSPHE-UHFFFAOYSA-N
MW314.17 g/mol
LogP3.22
Rot. Bonds4

About 2,6-dichloro-N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide

2,6-dichloro-N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide (PubChem CID 71975267) has the molecular formula C14H13Cl2NO3 and a molecular weight of 314.17 g/mol. Its IUPAC name is 2,6-dichloro-N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide.

Molecular Properties

Compound Name2,6-dichloro-N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide
PubChem CID71975267
Molecular FormulaC14H13Cl2NO3
Molecular Weight314.17 g/mol
Exact Mass313.03
IUPAC Name2,6-dichloro-N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide
SMILESCC(O)(CNC(=O)c1c(Cl)cccc1Cl)c1ccco1
InChIInChI=1S/C14H13Cl2NO3/c1-14(19,11-6-3-7-20-11)8-17-13(18)12-9(15)4-2-5-10(12)16/h2-7,19H,8H2,1H3,(H,17,18)
InChIKeyIEPVEOWZGVSPHE-UHFFFAOYSA-N
XLogP3.22
TPSA62.47 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.17
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide
CID 71782549
N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide
CID 111482452
5-chloro-N-[2-(furan-2-yl)-2-hydroxypropyl]furan-2-carboxamide
CID 111482154
3-chloro-N-[2-(furan-2-yl)-2-hydroxypropyl]pyridine-4-carboxamide
CID 111519619
2,4-dichloro-N-[(2R)-2-(furan-2-yl)-2-hydroxypropyl]-5-methylsulfanylbenzamide
CID 97321033
N-[2-(furan-2-yl)-2-hydroxypropyl]naphthalene-1-carboxamide
CID 71782562
2-chloro-N-[2-(furan-2-yl)-2-hydroxypropyl]pyridine-4-carboxamide
CID 111482264
methyl N-[2-(furan-2-yl)-2-hydroxypropyl]carbamate
CID 121085806
N-[(2S)-2-(furan-2-yl)-2-hydroxypropyl]-4-phenylbenzamide
CID 95983664
N-[2-(furan-2-yl)-2-hydroxypropyl]cyclopropanecarboxamide
CID 71782530
1-[2-(furan-2-yl)-2-hydroxypropyl]-3-(2,2,2-trifluoroethyl)urea
CID 111474174
N-[2-(furan-2-yl)-2-hydroxypropyl]-2-methyl-1H-indole-3-carboxamide
CID 111912254

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide?
The IUPAC name of 2,6-dichloro-N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide (CID 71975267) is 2,6-dichloro-N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide.
What is the SMILES notation for 2,6-dichloro-N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide?
The canonical SMILES for 2,6-dichloro-N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide is CC(O)(CNC(=O)c1c(Cl)cccc1Cl)c1ccco1.
What is the InChIKey of 2,6-dichloro-N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide?
The InChIKey is IEPVEOWZGVSPHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13Cl2NO3/c1-14(19,11-6-3-7-20-11)8-17-13(18)12-9(15)4-2-5-10(12)16/h2-7,19H,8H2,1H3,(H,17,18).
What are the key properties of 2,6-dichloro-N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide?
2,6-dichloro-N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide has a molecular weight of 314.17 g/mol, XLogP of 3.22, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide is sourced from PubChem (CID 71975267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).