N-(3,5-dichlorophenyl)-3-piperidin-1-ylpropanamide

C14H18Cl2N2O — CID 23906957

IUPACN-(3,5-dichlorophenyl)-3-piperidin-1-ylpropanamide
SMILESO=C(CCN1CCCCC1)Nc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C14H18Cl2N2O/c15-11-8-12(16)10-13(9-11)17-14(19)4-7-18-5-2-1-3-6-18/h8-10H,1-7H2,(H,17,19)
InChIKeyDATDTQJGVTWGNW-UHFFFAOYSA-N
MW301.22 g/mol
LogP3.81
Rot. Bonds4

About N-(3,5-dichlorophenyl)-3-piperidin-1-ylpropanamide

N-(3,5-dichlorophenyl)-3-piperidin-1-ylpropanamide (PubChem CID 23906957) has the molecular formula C14H18Cl2N2O and a molecular weight of 301.22 g/mol. Its IUPAC name is N-(3,5-dichlorophenyl)-3-piperidin-1-ylpropanamide.

Molecular Properties

Compound NameN-(3,5-dichlorophenyl)-3-piperidin-1-ylpropanamide
PubChem CID23906957
Molecular FormulaC14H18Cl2N2O
Molecular Weight301.22 g/mol
Exact Mass300.08
IUPAC NameN-(3,5-dichlorophenyl)-3-piperidin-1-ylpropanamide
SMILESO=C(CCN1CCCCC1)Nc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C14H18Cl2N2O/c15-11-8-12(16)10-13(9-11)17-14(19)4-7-18-5-2-1-3-6-18/h8-10H,1-7H2,(H,17,19)
InChIKeyDATDTQJGVTWGNW-UHFFFAOYSA-N
XLogP3.81
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.22
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-chlorophenyl)-3-piperidin-1-ylpropanamide chloride
CID 53313683
N-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]-3-piperidin-1-ylpropanamide
CID 4571611
N-(4-chlorophenyl)-3-piperidin-1-ylpropanamide chloride
CID 45109691
N-(3,5-dimethylphenyl)-3-piperidin-1-ylpropanamide
CID 771509
3-(azepan-1-yl)-N-(3,4-difluorophenyl)propanamide;hydrochloride
CID 90483211
N-(3,4-dimethylphenyl)-3-piperidin-1-ylpropanamide
CID 771569
3-[4-[2-(azepan-1-yl)-2-oxoethyl]piperazin-1-yl]-N-(3-chlorophenyl)propanamide
CID 55482910
N-(3-chloro-5-methoxyphenyl)-3-(4-methylpiperazin-1-yl)propanamide;hydrochloride
CID 2916697
N-[4-chloro-3-(trifluoromethyl)phenyl]-3-piperidin-1-ylpropanamide
CID 109013943
3-[3-(azepan-1-yl)propanoylamino]benzoic acid
CID 53215946
N-(3-chlorophenyl)-3-(1,4-diazepan-1-yl)propanamide
CID 43340911
ethane;N-(3-ethyl-5-hydroxyphenyl)-3-piperidin-1-ylpropanamide
CID 142203256

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dichlorophenyl)-3-piperidin-1-ylpropanamide?
The IUPAC name of N-(3,5-dichlorophenyl)-3-piperidin-1-ylpropanamide (CID 23906957) is N-(3,5-dichlorophenyl)-3-piperidin-1-ylpropanamide.
What is the SMILES notation for N-(3,5-dichlorophenyl)-3-piperidin-1-ylpropanamide?
The canonical SMILES for N-(3,5-dichlorophenyl)-3-piperidin-1-ylpropanamide is O=C(CCN1CCCCC1)Nc1cc(Cl)cc(Cl)c1.
What is the InChIKey of N-(3,5-dichlorophenyl)-3-piperidin-1-ylpropanamide?
The InChIKey is DATDTQJGVTWGNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18Cl2N2O/c15-11-8-12(16)10-13(9-11)17-14(19)4-7-18-5-2-1-3-6-18/h8-10H,1-7H2,(H,17,19).
What are the key properties of N-(3,5-dichlorophenyl)-3-piperidin-1-ylpropanamide?
N-(3,5-dichlorophenyl)-3-piperidin-1-ylpropanamide has a molecular weight of 301.22 g/mol, XLogP of 3.81, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dichlorophenyl)-3-piperidin-1-ylpropanamide is sourced from PubChem (CID 23906957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).