3-(2,4-dichlorophenyl)-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]propanamide

C20H24Cl2N2O2 — CID 46605718

IUPAC3-(2,4-dichlorophenyl)-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]propanamide
SMILESO=C(CCc1ccc(Cl)cc1Cl)NCC(c1ccco1)N1CCCCC1
InChIInChI=1S/C20H24Cl2N2O2/c21-16-8-6-15(17(22)13-16)7-9-20(25)23-14-18(19-5-4-12-26-19)24-10-2-1-3-11-24/h4-6,8,12-13,18H,1-3,7,9-11,14H2,(H,23,25)
InChIKeyIUUAWOFRTFKXJL-UHFFFAOYSA-N
MW395.33 g/mol
LogP4.86
Rot. Bonds7

About 3-(2,4-dichlorophenyl)-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]propanamide

3-(2,4-dichlorophenyl)-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]propanamide (PubChem CID 46605718) has the molecular formula C20H24Cl2N2O2 and a molecular weight of 395.33 g/mol. Its IUPAC name is 3-(2,4-dichlorophenyl)-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]propanamide.

Molecular Properties

Compound Name3-(2,4-dichlorophenyl)-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]propanamide
PubChem CID46605718
Molecular FormulaC20H24Cl2N2O2
Molecular Weight395.33 g/mol
Exact Mass394.12
IUPAC Name3-(2,4-dichlorophenyl)-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]propanamide
SMILESO=C(CCc1ccc(Cl)cc1Cl)NCC(c1ccco1)N1CCCCC1
InChIInChI=1S/C20H24Cl2N2O2/c21-16-8-6-15(17(22)13-16)7-9-20(25)23-14-18(19-5-4-12-26-19)24-10-2-1-3-11-24/h4-6,8,12-13,18H,1-3,7,9-11,14H2,(H,23,25)
InChIKeyIUUAWOFRTFKXJL-UHFFFAOYSA-N
XLogP4.86
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.33
LogP ≤ 54.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,4-dichlorophenyl)-3-[(2S)-2-(furan-2-yl)-2-piperidin-1-ylethyl]urea
CID 40952622
N-[2-(azepan-1-yl)-2-(furan-2-yl)ethyl]-2,4-dichlorobenzamide
CID 112503384
2,4-dichloro-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]benzamide
CID 18161350
2,4-dichloro-N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]benzamide
CID 40752685
N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-3-phenylpropanamide
CID 7780304
N-[2-(azepan-1-yl)-2-(furan-2-yl)ethyl]-2-(4-chlorophenoxy)acetamide
CID 112503361
N-[2-(azepan-1-yl)-2-(furan-2-yl)ethyl]butanamide
CID 112503325
4-chloro-N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]butanamide
CID 55204450
N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]butanamide
CID 60636600
N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]butanamide
CID 93157841
3-(1,3-benzodioxol-5-yl)-N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]propanamide
CID 110621655
N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-3-(1H-indol-3-yl)propanamide
CID 4807743

Frequently Asked Questions

What is the IUPAC name of 3-(2,4-dichlorophenyl)-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]propanamide?
The IUPAC name of 3-(2,4-dichlorophenyl)-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]propanamide (CID 46605718) is 3-(2,4-dichlorophenyl)-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]propanamide.
What is the SMILES notation for 3-(2,4-dichlorophenyl)-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]propanamide?
The canonical SMILES for 3-(2,4-dichlorophenyl)-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]propanamide is O=C(CCc1ccc(Cl)cc1Cl)NCC(c1ccco1)N1CCCCC1.
What is the InChIKey of 3-(2,4-dichlorophenyl)-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]propanamide?
The InChIKey is IUUAWOFRTFKXJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24Cl2N2O2/c21-16-8-6-15(17(22)13-16)7-9-20(25)23-14-18(19-5-4-12-26-19)24-10-2-1-3-11-24/h4-6,8,12-13,18H,1-3,7,9-11,14H2,(H,23,25).
What are the key properties of 3-(2,4-dichlorophenyl)-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]propanamide?
3-(2,4-dichlorophenyl)-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]propanamide has a molecular weight of 395.33 g/mol, XLogP of 4.86, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,4-dichlorophenyl)-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]propanamide is sourced from PubChem (CID 46605718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).