4-(3,4-dichlorophenyl)-N-piperidin-4-ylbutanamide

C15H20Cl2N2O — CID 119388494

IUPAC4-(3,4-dichlorophenyl)-N-piperidin-4-ylbutanamide
SMILESO=C(CCCc1ccc(Cl)c(Cl)c1)NC1CCNCC1
InChIInChI=1S/C15H20Cl2N2O/c16-13-5-4-11(10-14(13)17)2-1-3-15(20)19-12-6-8-18-9-7-12/h4-5,10,12,18H,1-3,6-9H2,(H,19,20)
InChIKeyCTIOUOVOEZSEBM-UHFFFAOYSA-N
MW315.24 g/mol
LogP3.18
Rot. Bonds5

About 4-(3,4-dichlorophenyl)-N-piperidin-4-ylbutanamide

4-(3,4-dichlorophenyl)-N-piperidin-4-ylbutanamide (PubChem CID 119388494) has the molecular formula C15H20Cl2N2O and a molecular weight of 315.24 g/mol. Its IUPAC name is 4-(3,4-dichlorophenyl)-N-piperidin-4-ylbutanamide.

Molecular Properties

Compound Name4-(3,4-dichlorophenyl)-N-piperidin-4-ylbutanamide
PubChem CID119388494
Molecular FormulaC15H20Cl2N2O
Molecular Weight315.24 g/mol
Exact Mass314.10
IUPAC Name4-(3,4-dichlorophenyl)-N-piperidin-4-ylbutanamide
SMILESO=C(CCCc1ccc(Cl)c(Cl)c1)NC1CCNCC1
InChIInChI=1S/C15H20Cl2N2O/c16-13-5-4-11(10-14(13)17)2-1-3-15(20)19-12-6-8-18-9-7-12/h4-5,10,12,18H,1-3,6-9H2,(H,19,20)
InChIKeyCTIOUOVOEZSEBM-UHFFFAOYSA-N
XLogP3.18
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.24
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-(3,4-dichlorophenyl)-N-piperidin-4-ylbutanamide;hydrochloride
CID 119388493
4-[4-(3,4-dichlorophenyl)butanoylamino]cyclohexane-1-carboxylic acid
CID 119229226
4-(4-methoxyphenyl)-N-piperidin-4-ylbutanamide;hydrochloride
CID 119385919
N-cyclopropyl-2-(3,4-dichlorophenyl)acetamide
CID 2682748
N-(azepan-4-yl)-4-phenylbutanamide
CID 105059135
4-(3,4-difluorophenyl)-N-pyrrolidin-3-ylbutanamide;hydrochloride
CID 119451917
4-(3,4-dichlorophenyl)-N-(piperidin-3-ylmethyl)butanamide
CID 119462608
6-phenyl-N-piperidin-4-ylhexanamide
CID 154665785
4-(3,4-dichlorophenyl)-1-piperazin-1-ylbutan-1-one
CID 83931253
4-(4-methylphenyl)-N-pyrrolidin-3-ylbutanamide;hydrochloride
CID 119453431
6-(4-methoxyphenyl)-N-piperidin-4-ylhexanamide
CID 119387370
N-cyclohexyl-2-(3,4-dichlorophenyl)acetamide
CID 2557208

Frequently Asked Questions

What is the IUPAC name of 4-(3,4-dichlorophenyl)-N-piperidin-4-ylbutanamide?
The IUPAC name of 4-(3,4-dichlorophenyl)-N-piperidin-4-ylbutanamide (CID 119388494) is 4-(3,4-dichlorophenyl)-N-piperidin-4-ylbutanamide.
What is the SMILES notation for 4-(3,4-dichlorophenyl)-N-piperidin-4-ylbutanamide?
The canonical SMILES for 4-(3,4-dichlorophenyl)-N-piperidin-4-ylbutanamide is O=C(CCCc1ccc(Cl)c(Cl)c1)NC1CCNCC1.
What is the InChIKey of 4-(3,4-dichlorophenyl)-N-piperidin-4-ylbutanamide?
The InChIKey is CTIOUOVOEZSEBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20Cl2N2O/c16-13-5-4-11(10-14(13)17)2-1-3-15(20)19-12-6-8-18-9-7-12/h4-5,10,12,18H,1-3,6-9H2,(H,19,20).
What are the key properties of 4-(3,4-dichlorophenyl)-N-piperidin-4-ylbutanamide?
4-(3,4-dichlorophenyl)-N-piperidin-4-ylbutanamide has a molecular weight of 315.24 g/mol, XLogP of 3.18, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,4-dichlorophenyl)-N-piperidin-4-ylbutanamide is sourced from PubChem (CID 119388494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).