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

C15H21Cl3N2O — CID 119388493

IUPAC4-(3,4-dichlorophenyl)-N-piperidin-4-ylbutanamide;hydrochloride
SMILESCl.O=C(CCCc1ccc(Cl)c(Cl)c1)NC1CCNCC1
InChIInChI=1S/C15H20Cl2N2O.ClH/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);1H
InChIKeyTUSMAWZXKGWYBM-UHFFFAOYSA-N
MW351.71 g/mol
LogP3.61
Rot. Bonds5

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

4-(3,4-dichlorophenyl)-N-piperidin-4-ylbutanamide;hydrochloride (PubChem CID 119388493) has the molecular formula C15H21Cl3N2O and a molecular weight of 351.71 g/mol. Its IUPAC name is 4-(3,4-dichlorophenyl)-N-piperidin-4-ylbutanamide;hydrochloride.

Molecular Properties

Compound Name4-(3,4-dichlorophenyl)-N-piperidin-4-ylbutanamide;hydrochloride
PubChem CID119388493
Molecular FormulaC15H21Cl3N2O
Molecular Weight351.71 g/mol
Exact Mass350.07
IUPAC Name4-(3,4-dichlorophenyl)-N-piperidin-4-ylbutanamide;hydrochloride
SMILESCl.O=C(CCCc1ccc(Cl)c(Cl)c1)NC1CCNCC1
InChIInChI=1S/C15H20Cl2N2O.ClH/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);1H
InChIKeyTUSMAWZXKGWYBM-UHFFFAOYSA-N
XLogP3.61
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.71
LogP ≤ 53.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-(3,4-dichlorophenyl)-N-piperidin-4-ylbutanamide
CID 119388494
4-[4-(3,4-dichlorophenyl)butanoylamino]cyclohexane-1-carboxylic acid
CID 119229226
4-(4-methoxyphenyl)-N-piperidin-4-ylbutanamide;hydrochloride
CID 119385919
4-(3,4-difluorophenyl)-N-pyrrolidin-3-ylbutanamide;hydrochloride
CID 119451917
N-cyclopropyl-2-(3,4-dichlorophenyl)acetamide
CID 2682748
4-(4-methylphenyl)-N-pyrrolidin-3-ylbutanamide;hydrochloride
CID 119453431
N-(azepan-4-yl)-4-phenylbutanamide
CID 105059135
4-(3,4-dichlorophenyl)-N-(piperidin-3-ylmethyl)butanamide
CID 119462608
6-phenyl-N-piperidin-4-ylhexanamide
CID 154665785
2-(3,4-dichlorophenoxy)-N-piperidin-4-ylacetamide;hydrochloride
CID 119386912
4-(3,4-dichlorophenyl)-1-piperazin-1-ylbutan-1-one
CID 83931253
4-(3,4-dichlorophenyl)-N-piperidin-4-yl-N-propylbutanamide;hydrochloride
CID 119824958

Frequently Asked Questions

What is the IUPAC name of 4-(3,4-dichlorophenyl)-N-piperidin-4-ylbutanamide;hydrochloride?
The IUPAC name of 4-(3,4-dichlorophenyl)-N-piperidin-4-ylbutanamide;hydrochloride (CID 119388493) is 4-(3,4-dichlorophenyl)-N-piperidin-4-ylbutanamide;hydrochloride.
What is the SMILES notation for 4-(3,4-dichlorophenyl)-N-piperidin-4-ylbutanamide;hydrochloride?
The canonical SMILES for 4-(3,4-dichlorophenyl)-N-piperidin-4-ylbutanamide;hydrochloride is Cl.O=C(CCCc1ccc(Cl)c(Cl)c1)NC1CCNCC1.
What is the InChIKey of 4-(3,4-dichlorophenyl)-N-piperidin-4-ylbutanamide;hydrochloride?
The InChIKey is TUSMAWZXKGWYBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20Cl2N2O.ClH/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);1H.
What are the key properties of 4-(3,4-dichlorophenyl)-N-piperidin-4-ylbutanamide;hydrochloride?
4-(3,4-dichlorophenyl)-N-piperidin-4-ylbutanamide;hydrochloride has a molecular weight of 351.71 g/mol, XLogP of 3.61, 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;hydrochloride is sourced from PubChem (CID 119388493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).