N-(2,5-dichlorophenyl)-3-(5-methylfuran-2-yl)propanamide

C14H13Cl2NO2 — CID 882763

IUPACN-(2,5-dichlorophenyl)-3-(5-methylfuran-2-yl)propanamide
SMILESCc1ccc(CCC(=O)Nc2cc(Cl)ccc2Cl)o1
InChIInChI=1S/C14H13Cl2NO2/c1-9-2-4-11(19-9)5-7-14(18)17-13-8-10(15)3-6-12(13)16/h2-4,6,8H,5,7H2,1H3,(H,17,18)
InChIKeyILAQHXQAWFUOFT-UHFFFAOYSA-N
MW298.17 g/mol
LogP4.47
Rot. Bonds4

About N-(2,5-dichlorophenyl)-3-(5-methylfuran-2-yl)propanamide

N-(2,5-dichlorophenyl)-3-(5-methylfuran-2-yl)propanamide (PubChem CID 882763) has the molecular formula C14H13Cl2NO2 and a molecular weight of 298.17 g/mol. Its IUPAC name is N-(2,5-dichlorophenyl)-3-(5-methylfuran-2-yl)propanamide.

Molecular Properties

Compound NameN-(2,5-dichlorophenyl)-3-(5-methylfuran-2-yl)propanamide
PubChem CID882763
Molecular FormulaC14H13Cl2NO2
Molecular Weight298.17 g/mol
Exact Mass297.03
IUPAC NameN-(2,5-dichlorophenyl)-3-(5-methylfuran-2-yl)propanamide
SMILESCc1ccc(CCC(=O)Nc2cc(Cl)ccc2Cl)o1
InChIInChI=1S/C14H13Cl2NO2/c1-9-2-4-11(19-9)5-7-14(18)17-13-8-10(15)3-6-12(13)16/h2-4,6,8H,5,7H2,1H3,(H,17,18)
InChIKeyILAQHXQAWFUOFT-UHFFFAOYSA-N
XLogP4.47
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.17
LogP ≤ 54.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

AR420626
CID 91885415
N-(4-chlorophenyl)-3-(5-methylfuran-2-yl)propanamide
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CID 942336
N-(2-chloro-4-nitrophenyl)-3-(5-methyl-2-furyl)propanamide
CID 2918839
(2E)-N-(3-chlorophenyl)-2-cyano-3-(5-methylfuran-2-yl)prop-2-enamide
CID 738825
(E)-N-(2-chlorophenyl)-2-cyano-3-[5-(2-methylcyclopropyl)furan-2-yl]prop-2-enamide
CID 5774261
(E)-2-Cyano-N-(2,5-dichlorophenyl)-3-(5-(2-methylcyclopropyl)furan-2-yl)acrylamide
CID 5845751
N-(4-ethoxyphenyl)-3-(5-methylfuran-2-yl)propanamide
CID 2243182
3-(5-ethylfuran-2-yl)-N-(4-methoxyphenyl)propanamide
CID 940787
(2E)-N-(2,4-dichlorophenyl)-3-(furan-2-yl)prop-2-enamide
CID 790279
N-(2,4-dichlorophenyl)-3-(5-methylfuran-2-yl)propanamide
CID 959186
3-(3-Chloro-phenylamino)-5-furan-2-yl-cyclohex-2-enone
CID 2886782

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dichlorophenyl)-3-(5-methylfuran-2-yl)propanamide?
The IUPAC name of N-(2,5-dichlorophenyl)-3-(5-methylfuran-2-yl)propanamide (CID 882763) is N-(2,5-dichlorophenyl)-3-(5-methylfuran-2-yl)propanamide.
What is the SMILES notation for N-(2,5-dichlorophenyl)-3-(5-methylfuran-2-yl)propanamide?
The canonical SMILES for N-(2,5-dichlorophenyl)-3-(5-methylfuran-2-yl)propanamide is Cc1ccc(CCC(=O)Nc2cc(Cl)ccc2Cl)o1.
What is the InChIKey of N-(2,5-dichlorophenyl)-3-(5-methylfuran-2-yl)propanamide?
The InChIKey is ILAQHXQAWFUOFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13Cl2NO2/c1-9-2-4-11(19-9)5-7-14(18)17-13-8-10(15)3-6-12(13)16/h2-4,6,8H,5,7H2,1H3,(H,17,18).
What are the key properties of N-(2,5-dichlorophenyl)-3-(5-methylfuran-2-yl)propanamide?
N-(2,5-dichlorophenyl)-3-(5-methylfuran-2-yl)propanamide has a molecular weight of 298.17 g/mol, XLogP of 4.47, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dichlorophenyl)-3-(5-methylfuran-2-yl)propanamide is sourced from PubChem (CID 882763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).