5-(3-chlorophenyl)-N-(2-piperidin-1-ylphenyl)furan-2-carboxamide

C22H21ClN2O2 — CID 3656622

IUPAC5-(3-chlorophenyl)-N-(2-piperidin-1-ylphenyl)furan-2-carboxamide
SMILESO=C(Nc1ccccc1N1CCCCC1)c1ccc(-c2cccc(Cl)c2)o1
InChIInChI=1S/C22H21ClN2O2/c23-17-8-6-7-16(15-17)20-11-12-21(27-20)22(26)24-18-9-2-3-10-19(18)25-13-4-1-5-14-25/h2-3,6-12,15H,1,4-5,13-14H2,(H,24,26)
InChIKeyHMNUBSRKWSGBER-UHFFFAOYSA-N
MW380.88 g/mol
LogP5.84
Rot. Bonds4

About 5-(3-chlorophenyl)-N-(2-piperidin-1-ylphenyl)furan-2-carboxamide

5-(3-chlorophenyl)-N-(2-piperidin-1-ylphenyl)furan-2-carboxamide (PubChem CID 3656622) has the molecular formula C22H21ClN2O2 and a molecular weight of 380.88 g/mol. Its IUPAC name is 5-(3-chlorophenyl)-N-(2-piperidin-1-ylphenyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-(3-chlorophenyl)-N-(2-piperidin-1-ylphenyl)furan-2-carboxamide
PubChem CID3656622
Molecular FormulaC22H21ClN2O2
Molecular Weight380.88 g/mol
Exact Mass380.13
IUPAC Name5-(3-chlorophenyl)-N-(2-piperidin-1-ylphenyl)furan-2-carboxamide
SMILESO=C(Nc1ccccc1N1CCCCC1)c1ccc(-c2cccc(Cl)c2)o1
InChIInChI=1S/C22H21ClN2O2/c23-17-8-6-7-16(15-17)20-11-12-21(27-20)22(26)24-18-9-2-3-10-19(18)25-13-4-1-5-14-25/h2-3,6-12,15H,1,4-5,13-14H2,(H,24,26)
InChIKeyHMNUBSRKWSGBER-UHFFFAOYSA-N
XLogP5.84
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500380.88
LogP ≤ 55.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(4-benzoylpiperazin-1-yl)phenyl]-5-(3-chlorophenyl)furan-2-carboxamide
CID 17117874
5-(3-chlorophenyl)-N-[2-(4-propanoylpiperazin-1-yl)phenyl]furan-2-carboxamide
CID 22780800
5-(3,4-dichlorophenyl)-N-[2-(4-methylpiperazin-1-yl)phenyl]furan-2-carboxamide
CID 2237354
N-[[2-[4-(4-chlorobenzoyl)piperazin-1-yl]phenyl]carbamothioyl]-5-(3-chlorophenyl)furan-2-carboxamide
CID 17317476
5-(3-chlorophenyl)-N-[[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]carbamothioyl]furan-2-carboxamide
CID 17115725
5-(4-acetylphenyl)-N-(5-chloro-2-piperidin-1-ylphenyl)furan-2-carboxamide
CID 4965545
N-[3-chloro-2-(4-ethylpiperazin-1-yl)phenyl]-5-(3-chlorophenyl)furan-2-carboxamide
CID 3989552
N-[2-(4-butanoylpiperazin-1-yl)-5-chlorophenyl]-5-(3-chlorophenyl)furan-2-carboxamide
CID 17091564
5-(4-chlorophenyl)-N-[2-(4-methylpiperidin-1-yl)phenyl]furan-2-carboxamide
CID 5144971
N-[4-(4-acetylpiperazin-1-yl)-3-chlorophenyl]-5-(3-chlorophenyl)furan-2-carboxamide
CID 17111808
5-cyano-N-(2-piperidin-1-ylphenyl)furan-2-carboxamide
CID 11231718
5-(3-chlorophenyl)-N-(2-chloro-3-pyridinyl)furan-2-carboxamide
CID 17099107

Frequently Asked Questions

What is the IUPAC name of 5-(3-chlorophenyl)-N-(2-piperidin-1-ylphenyl)furan-2-carboxamide?
The IUPAC name of 5-(3-chlorophenyl)-N-(2-piperidin-1-ylphenyl)furan-2-carboxamide (CID 3656622) is 5-(3-chlorophenyl)-N-(2-piperidin-1-ylphenyl)furan-2-carboxamide.
What is the SMILES notation for 5-(3-chlorophenyl)-N-(2-piperidin-1-ylphenyl)furan-2-carboxamide?
The canonical SMILES for 5-(3-chlorophenyl)-N-(2-piperidin-1-ylphenyl)furan-2-carboxamide is O=C(Nc1ccccc1N1CCCCC1)c1ccc(-c2cccc(Cl)c2)o1.
What is the InChIKey of 5-(3-chlorophenyl)-N-(2-piperidin-1-ylphenyl)furan-2-carboxamide?
The InChIKey is HMNUBSRKWSGBER-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21ClN2O2/c23-17-8-6-7-16(15-17)20-11-12-21(27-20)22(26)24-18-9-2-3-10-19(18)25-13-4-1-5-14-25/h2-3,6-12,15H,1,4-5,13-14H2,(H,24,26).
What are the key properties of 5-(3-chlorophenyl)-N-(2-piperidin-1-ylphenyl)furan-2-carboxamide?
5-(3-chlorophenyl)-N-(2-piperidin-1-ylphenyl)furan-2-carboxamide has a molecular weight of 380.88 g/mol, XLogP of 5.84, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-chlorophenyl)-N-(2-piperidin-1-ylphenyl)furan-2-carboxamide is sourced from PubChem (CID 3656622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).