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

C14H19Cl2N2O- — CID 53313683

IUPACN-(3-chlorophenyl)-3-piperidin-1-ylpropanamide chloride
SMILESO=C(CCN1CCCCC1)Nc1cccc(Cl)c1.[Cl-]
InChIInChI=1S/C14H19ClN2O.ClH/c15-12-5-4-6-13(11-12)16-14(18)7-10-17-8-2-1-3-9-17;/h4-6,11H,1-3,7-10H2,(H,16,18);1H/p-1
InChIKeyVKJAZOCCJBMKJT-UHFFFAOYSA-M
MW302.22 g/mol
LogP0.16
Rot. Bonds4

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

N-(3-chlorophenyl)-3-piperidin-1-ylpropanamide chloride (PubChem CID 53313683) has the molecular formula C14H19Cl2N2O- and a molecular weight of 302.22 g/mol. Its IUPAC name is N-(3-chlorophenyl)-3-piperidin-1-ylpropanamide chloride.

Molecular Properties

Compound NameN-(3-chlorophenyl)-3-piperidin-1-ylpropanamide chloride
PubChem CID53313683
Molecular FormulaC14H19Cl2N2O-
Molecular Weight302.22 g/mol
Exact Mass301.09
IUPAC NameN-(3-chlorophenyl)-3-piperidin-1-ylpropanamide chloride
SMILESO=C(CCN1CCCCC1)Nc1cccc(Cl)c1.[Cl-]
InChIInChI=1S/C14H19ClN2O.ClH/c15-12-5-4-6-13(11-12)16-14(18)7-10-17-8-2-1-3-9-17;/h4-6,11H,1-3,7-10H2,(H,16,18);1H/p-1
InChIKeyVKJAZOCCJBMKJT-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

3-[4-[2-(azepan-1-yl)-2-oxoethyl]piperazin-1-yl]-N-(3-chlorophenyl)propanamide
CID 55482910
N-(3-chlorophenyl)-3-(1,4-diazepan-1-yl)propanamide
CID 43340911
N-(3,5-dichlorophenyl)-3-piperidin-1-ylpropanamide
CID 23906957
N-(3-chlorophenyl)-3-(4-methylpiperidin-1-yl)propanamide
CID 109014570
N-(4-chlorophenyl)-3-piperidin-1-ylpropanamide chloride
CID 45109691
N-(3-chlorophenyl)-2-(2-pyrrolidin-1-ylethylamino)acetamide
CID 55023239
3-[3-(azepan-1-yl)propanoylamino]benzoic acid
CID 53215946
N-(3-chlorophenyl)-2-pyrrolidin-1-ylacetamide;hydrochloride
CID 2917131
N-(3-chlorophenyl)-3-(4-phenylpiperazin-1-yl)propanamide;hydrochloride
CID 19661841
ethane;N-(3-methylphenyl)-3-piperidin-1-ylpropanamide
CID 143383579
3-(4-benzoylpiperidin-1-yl)-N-(3-chlorophenyl)propanamide
CID 33215010
N-(3-chlorophenyl)-3-[2-(hydroxymethyl)azepan-1-yl]propanamide
CID 116637464

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-3-piperidin-1-ylpropanamide chloride?
The IUPAC name of N-(3-chlorophenyl)-3-piperidin-1-ylpropanamide chloride (CID 53313683) is N-(3-chlorophenyl)-3-piperidin-1-ylpropanamide chloride.
What is the SMILES notation for N-(3-chlorophenyl)-3-piperidin-1-ylpropanamide chloride?
The canonical SMILES for N-(3-chlorophenyl)-3-piperidin-1-ylpropanamide chloride is O=C(CCN1CCCCC1)Nc1cccc(Cl)c1.[Cl-].
What is the InChIKey of N-(3-chlorophenyl)-3-piperidin-1-ylpropanamide chloride?
The InChIKey is VKJAZOCCJBMKJT-UHFFFAOYSA-M. The full InChI is InChI=1S/C14H19ClN2O.ClH/c15-12-5-4-6-13(11-12)16-14(18)7-10-17-8-2-1-3-9-17;/h4-6,11H,1-3,7-10H2,(H,16,18);1H/p-1.
What are the key properties of N-(3-chlorophenyl)-3-piperidin-1-ylpropanamide chloride?
N-(3-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-(3-chlorophenyl)-3-piperidin-1-ylpropanamide chloride is sourced from PubChem (CID 53313683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).