5-(4-chlorophenyl)-N-[2-(diethylamino)ethyl]furan-2-carboxamide

C17H21ClN2O2 — CID 29368987

IUPAC5-(4-chlorophenyl)-N-[2-(diethylamino)ethyl]furan-2-carboxamide
SMILESCCN(CC)CCNC(=O)c1ccc(-c2ccc(Cl)cc2)o1
InChIInChI=1S/C17H21ClN2O2/c1-3-20(4-2)12-11-19-17(21)16-10-9-15(22-16)13-5-7-14(18)8-6-13/h5-10H,3-4,11-12H2,1-2H3,(H,19,21)
InChIKeyUWEVXLKPQIEOBG-UHFFFAOYSA-N
MW320.82 g/mol
LogP3.67
Rot. Bonds7

About 5-(4-chlorophenyl)-N-[2-(diethylamino)ethyl]furan-2-carboxamide

5-(4-chlorophenyl)-N-[2-(diethylamino)ethyl]furan-2-carboxamide (PubChem CID 29368987) has the molecular formula C17H21ClN2O2 and a molecular weight of 320.82 g/mol. Its IUPAC name is 5-(4-chlorophenyl)-N-[2-(diethylamino)ethyl]furan-2-carboxamide.

Molecular Properties

Compound Name5-(4-chlorophenyl)-N-[2-(diethylamino)ethyl]furan-2-carboxamide
PubChem CID29368987
Molecular FormulaC17H21ClN2O2
Molecular Weight320.82 g/mol
Exact Mass320.13
IUPAC Name5-(4-chlorophenyl)-N-[2-(diethylamino)ethyl]furan-2-carboxamide
SMILESCCN(CC)CCNC(=O)c1ccc(-c2ccc(Cl)cc2)o1
InChIInChI=1S/C17H21ClN2O2/c1-3-20(4-2)12-11-19-17(21)16-10-9-15(22-16)13-5-7-14(18)8-6-13/h5-10H,3-4,11-12H2,1-2H3,(H,19,21)
InChIKeyUWEVXLKPQIEOBG-UHFFFAOYSA-N
XLogP3.67
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.82
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(4-chlorophenyl)-N-[2-(2-methylpropanoylamino)ethyl]furan-2-carboxamide
CID 24503555
5-[(4-chlorophenoxy)methyl]-N-[2-(diethylamino)ethyl]furan-2-carboxamide
CID 19415421
5-(4-chlorophenyl)-N-[2-(ethylamino)-2-oxoethyl]furan-2-carboxamide
CID 18145739
5-(4-chlorophenyl)-N-(2-morpholin-4-ylethyl)furan-2-carboxamide
CID 18162315
5-(4-chlorophenyl)-N-[2-(4-propylphenoxy)ethyl]furan-2-carboxamide
CID 4919266
5-(4-chlorophenyl)-N-hydroxyfuran-2-carboxamide
CID 91678227
N-(2-aminoethyl)-5-(4-methoxyphenyl)furan-2-carboxamide
CID 94273188
5-[(4-chlorophenoxy)methyl]-N-[3-(diethylamino)propyl]furan-2-carboxamide
CID 19415422
N-[2-(diethylamino)ethyl]-5-[(2,4,6-trichlorophenoxy)methyl]furan-2-carboxamide
CID 19415635
5-(4-ethylphenyl)-N-[2-(methylamino)ethyl]furan-2-carboxamide;hydrochloride
CID 119502712
N,5-bis(4-chlorophenyl)furan-2-carboxamide
CID 781867
5-(4-acetylphenyl)-N-[4-(4-chlorophenoxy)butyl]furan-2-carboxamide
CID 18286334

Frequently Asked Questions

What is the IUPAC name of 5-(4-chlorophenyl)-N-[2-(diethylamino)ethyl]furan-2-carboxamide?
The IUPAC name of 5-(4-chlorophenyl)-N-[2-(diethylamino)ethyl]furan-2-carboxamide (CID 29368987) is 5-(4-chlorophenyl)-N-[2-(diethylamino)ethyl]furan-2-carboxamide.
What is the SMILES notation for 5-(4-chlorophenyl)-N-[2-(diethylamino)ethyl]furan-2-carboxamide?
The canonical SMILES for 5-(4-chlorophenyl)-N-[2-(diethylamino)ethyl]furan-2-carboxamide is CCN(CC)CCNC(=O)c1ccc(-c2ccc(Cl)cc2)o1.
What is the InChIKey of 5-(4-chlorophenyl)-N-[2-(diethylamino)ethyl]furan-2-carboxamide?
The InChIKey is UWEVXLKPQIEOBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21ClN2O2/c1-3-20(4-2)12-11-19-17(21)16-10-9-15(22-16)13-5-7-14(18)8-6-13/h5-10H,3-4,11-12H2,1-2H3,(H,19,21).
What are the key properties of 5-(4-chlorophenyl)-N-[2-(diethylamino)ethyl]furan-2-carboxamide?
5-(4-chlorophenyl)-N-[2-(diethylamino)ethyl]furan-2-carboxamide has a molecular weight of 320.82 g/mol, XLogP of 3.67, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-chlorophenyl)-N-[2-(diethylamino)ethyl]furan-2-carboxamide is sourced from PubChem (CID 29368987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).