N-(4-chlorophenyl)-3-piperidin-1-ylpropanamide chloride

C14H19Cl2N2O- — CID 45109691

IUPACN-(4-chlorophenyl)-3-piperidin-1-ylpropanamide chloride
SMILESO=C(CCN1CCCCC1)Nc1ccc(Cl)cc1.[Cl-]
InChIInChI=1S/C14H19ClN2O.ClH/c15-12-4-6-13(7-5-12)16-14(18)8-11-17-9-2-1-3-10-17;/h4-7H,1-3,8-11H2,(H,16,18);1H/p-1
InChIKeyUZBYYCBMYCGBKW-UHFFFAOYSA-M
MW302.22 g/mol
LogP0.16
Rot. Bonds4

About N-(4-chlorophenyl)-3-piperidin-1-ylpropanamide chloride

N-(4-chlorophenyl)-3-piperidin-1-ylpropanamide chloride (PubChem CID 45109691) has the molecular formula C14H19Cl2N2O- and a molecular weight of 302.22 g/mol. Its IUPAC name is N-(4-chlorophenyl)-3-piperidin-1-ylpropanamide chloride.

Molecular Properties

Compound NameN-(4-chlorophenyl)-3-piperidin-1-ylpropanamide chloride
PubChem CID45109691
Molecular FormulaC14H19Cl2N2O-
Molecular Weight302.22 g/mol
Exact Mass301.09
IUPAC NameN-(4-chlorophenyl)-3-piperidin-1-ylpropanamide chloride
SMILESO=C(CCN1CCCCC1)Nc1ccc(Cl)cc1.[Cl-]
InChIInChI=1S/C14H19ClN2O.ClH/c15-12-4-6-13(7-5-12)16-14(18)8-11-17-9-2-1-3-10-17;/h4-7H,1-3,8-11H2,(H,16,18);1H/p-1
InChIKeyUZBYYCBMYCGBKW-UHFFFAOYSA-M
XLogP0.16
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.22
LogP ≤ 50.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3,5-dichlorophenyl)-3-piperidin-1-ylpropanamide
CID 23906957
N-(3-chlorophenyl)-3-piperidin-1-ylpropanamide chloride
CID 53313683
3-(azepan-1-yl)-N-(3,4-difluorophenyl)propanamide;hydrochloride
CID 90483211
N-(4-formylphenyl)-3-piperidin-1-ylpropanamide
CID 123230186
N-(4-chlorophenyl)-3-[4-(2-methylpropyl)piperazin-1-yl]propanamide
CID 60503579
N-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]-3-piperidin-1-ylpropanamide
CID 4571611
3-(azocan-1-yl)-N-(4-cyanophenyl)propanamide
CID 28801310
N-(4-acetylphenyl)-3-piperidin-1-ylpropanamide;hydrochloride
CID 155569851
4-(3-pyrrolidin-1-ylpropanoylamino)benzamide
CID 110688218
N-(4-chlorophenyl)-3-[3-(hydroxymethyl)piperidin-1-yl]propanamide
CID 111750178
N-(4-chlorophenyl)-2-(3-pyrrolidin-1-ylpropylamino)acetamide
CID 60673794
N-[(4-chlorophenyl)methyl]-3-piperidin-1-ylpropanamide
CID 110688285

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-3-piperidin-1-ylpropanamide chloride?
The IUPAC name of N-(4-chlorophenyl)-3-piperidin-1-ylpropanamide chloride (CID 45109691) is N-(4-chlorophenyl)-3-piperidin-1-ylpropanamide chloride.
What is the SMILES notation for N-(4-chlorophenyl)-3-piperidin-1-ylpropanamide chloride?
The canonical SMILES for N-(4-chlorophenyl)-3-piperidin-1-ylpropanamide chloride is O=C(CCN1CCCCC1)Nc1ccc(Cl)cc1.[Cl-].
What is the InChIKey of N-(4-chlorophenyl)-3-piperidin-1-ylpropanamide chloride?
The InChIKey is UZBYYCBMYCGBKW-UHFFFAOYSA-M. The full InChI is InChI=1S/C14H19ClN2O.ClH/c15-12-4-6-13(7-5-12)16-14(18)8-11-17-9-2-1-3-10-17;/h4-7H,1-3,8-11H2,(H,16,18);1H/p-1.
What are the key properties of N-(4-chlorophenyl)-3-piperidin-1-ylpropanamide chloride?
N-(4-chlorophenyl)-3-piperidin-1-ylpropanamide chloride has a molecular weight of 302.22 g/mol, XLogP of 0.16, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-3-piperidin-1-ylpropanamide chloride is sourced from PubChem (CID 45109691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).