5-(2,6-dichlorophenyl)-N-propan-2-ylfuran-2-carboxamide

C14H13Cl2NO2 — CID 17015033

IUPAC5-(2,6-dichlorophenyl)-N-propan-2-ylfuran-2-carboxamide
SMILESCC(C)NC(=O)c1ccc(-c2c(Cl)cccc2Cl)o1
InChIInChI=1S/C14H13Cl2NO2/c1-8(2)17-14(18)12-7-6-11(19-12)13-9(15)4-3-5-10(13)16/h3-8H,1-2H3,(H,17,18)
InChIKeyRHEMDPVZBCMIGC-UHFFFAOYSA-N
MW298.17 g/mol
LogP4.39
Rot. Bonds3

About 5-(2,6-dichlorophenyl)-N-propan-2-ylfuran-2-carboxamide

5-(2,6-dichlorophenyl)-N-propan-2-ylfuran-2-carboxamide (PubChem CID 17015033) has the molecular formula C14H13Cl2NO2 and a molecular weight of 298.17 g/mol. Its IUPAC name is 5-(2,6-dichlorophenyl)-N-propan-2-ylfuran-2-carboxamide.

Molecular Properties

Compound Name5-(2,6-dichlorophenyl)-N-propan-2-ylfuran-2-carboxamide
PubChem CID17015033
Molecular FormulaC14H13Cl2NO2
Molecular Weight298.17 g/mol
Exact Mass297.03
IUPAC Name5-(2,6-dichlorophenyl)-N-propan-2-ylfuran-2-carboxamide
SMILESCC(C)NC(=O)c1ccc(-c2c(Cl)cccc2Cl)o1
InChIInChI=1S/C14H13Cl2NO2/c1-8(2)17-14(18)12-7-6-11(19-12)13-9(15)4-3-5-10(13)16/h3-8H,1-2H3,(H,17,18)
InChIKeyRHEMDPVZBCMIGC-UHFFFAOYSA-N
XLogP4.39
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.17
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-(3-methylphenyl)-N-propan-2-ylfuran-2-carboxamide
CID 151471229
5-(2-chlorophenyl)-N-(1-methoxypropan-2-yl)furan-2-carboxamide
CID 18161050
5-(4-fluorophenyl)-N-propan-2-ylfuran-2-carboxamide
CID 4290851
5-[4-chloro-3-(trifluoromethyl)phenyl]-N-propan-2-ylfuran-2-carboxamide
CID 1253325
5-(2-chlorophenyl)-N-(1-phenylethyl)furan-2-carboxamide
CID 5262420
4-[[5-(2,6-dichlorophenyl)furan-2-carbonyl]amino]benzoate
CID 9150445
5-[(2-chlorophenoxy)methyl]-N-propan-2-ylfuran-2-carboxamide
CID 6458696
(2R)-2-[[5-(2-chlorophenyl)furan-2-carbonyl]amino]-3-methylbutanoic acid
CID 119368356
5-(2-chlorophenyl)-N-(5-methylhexan-2-yl)furan-2-carboxamide
CID 16560702
5-(2,6-dichlorophenyl)-N-(2-oxo-2-thiophen-2-ylethyl)furan-2-carboxamide
CID 9150422
N-[1-(2-chloro-6-fluorophenyl)-1-hydroxypropan-2-yl]-5-(2-fluorophenyl)furan-2-carboxamide
CID 71864154
5-(2-chlorophenyl)-N-[(1R)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]furan-2-carboxamide
CID 97137892

Frequently Asked Questions

What is the IUPAC name of 5-(2,6-dichlorophenyl)-N-propan-2-ylfuran-2-carboxamide?
The IUPAC name of 5-(2,6-dichlorophenyl)-N-propan-2-ylfuran-2-carboxamide (CID 17015033) is 5-(2,6-dichlorophenyl)-N-propan-2-ylfuran-2-carboxamide.
What is the SMILES notation for 5-(2,6-dichlorophenyl)-N-propan-2-ylfuran-2-carboxamide?
The canonical SMILES for 5-(2,6-dichlorophenyl)-N-propan-2-ylfuran-2-carboxamide is CC(C)NC(=O)c1ccc(-c2c(Cl)cccc2Cl)o1.
What is the InChIKey of 5-(2,6-dichlorophenyl)-N-propan-2-ylfuran-2-carboxamide?
The InChIKey is RHEMDPVZBCMIGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13Cl2NO2/c1-8(2)17-14(18)12-7-6-11(19-12)13-9(15)4-3-5-10(13)16/h3-8H,1-2H3,(H,17,18).
What are the key properties of 5-(2,6-dichlorophenyl)-N-propan-2-ylfuran-2-carboxamide?
5-(2,6-dichlorophenyl)-N-propan-2-ylfuran-2-carboxamide has a molecular weight of 298.17 g/mol, XLogP of 4.39, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,6-dichlorophenyl)-N-propan-2-ylfuran-2-carboxamide is sourced from PubChem (CID 17015033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).