2-(4-cyanopiperidin-1-yl)-N-(2,5-dichlorophenyl)acetamide

C14H15Cl2N3O — CID 48940747

IUPAC2-(4-cyanopiperidin-1-yl)-N-(2,5-dichlorophenyl)acetamide
SMILESN#CC1CCN(CC(=O)Nc2cc(Cl)ccc2Cl)CC1
InChIInChI=1S/C14H15Cl2N3O/c15-11-1-2-12(16)13(7-11)18-14(20)9-19-5-3-10(8-17)4-6-19/h1-2,7,10H,3-6,9H2,(H,18,20)
InChIKeyCGPOGMCQGJBRBN-UHFFFAOYSA-N
MW312.20 g/mol
LogP3.17
Rot. Bonds3

About 2-(4-cyanopiperidin-1-yl)-N-(2,5-dichlorophenyl)acetamide

2-(4-cyanopiperidin-1-yl)-N-(2,5-dichlorophenyl)acetamide (PubChem CID 48940747) has the molecular formula C14H15Cl2N3O and a molecular weight of 312.20 g/mol. Its IUPAC name is 2-(4-cyanopiperidin-1-yl)-N-(2,5-dichlorophenyl)acetamide.

Molecular Properties

Compound Name2-(4-cyanopiperidin-1-yl)-N-(2,5-dichlorophenyl)acetamide
PubChem CID48940747
Molecular FormulaC14H15Cl2N3O
Molecular Weight312.20 g/mol
Exact Mass311.06
IUPAC Name2-(4-cyanopiperidin-1-yl)-N-(2,5-dichlorophenyl)acetamide
SMILESN#CC1CCN(CC(=O)Nc2cc(Cl)ccc2Cl)CC1
InChIInChI=1S/C14H15Cl2N3O/c15-11-1-2-12(16)13(7-11)18-14(20)9-19-5-3-10(8-17)4-6-19/h1-2,7,10H,3-6,9H2,(H,18,20)
InChIKeyCGPOGMCQGJBRBN-UHFFFAOYSA-N
XLogP3.17
TPSA56.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.20
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,5-dichlorophenyl)-2-[4-(methylaminomethyl)piperidin-1-yl]acetamide;hydrochloride
CID 119922555
N-(2,5-dichlorophenyl)-2-(4-ethylpiperazin-1-yl)acetamide
CID 6465282
1-[2-(2,5-dichloroanilino)-2-oxoethyl]-N-phenylpiperidine-4-carboxamide
CID 17486082
2-(3-aminopiperidin-1-yl)-N-(2,5-dichlorophenyl)acetamide
CID 61298143
2-(4-amino-3-ethylpiperidin-1-yl)-N-(2,5-dichlorophenyl)acetamide
CID 81452927
2-(4-cyanopiperidin-1-yl)-N-phenylacetamide
CID 48940732
N-(2,5-dichlorophenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide
CID 62545625
2-(1,4-diazepan-1-yl)-N-(2,5-dichlorophenyl)acetamide;hydrochloride
CID 119906433
2-[4-[2-(2,5-dichloroanilino)-2-oxoethyl]piperazin-1-yl]-N-prop-2-enylacetamide
CID 46663083
N-(2,5-dichlorophenyl)-2-[4-(pyridin-4-ylmethyl)piperazin-1-yl]acetamide
CID 172904520
2-(2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl)-N-(2,5-dichlorophenyl)acetamide
CID 60972401
N-(2,5-dichlorophenyl)-2-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)acetamide
CID 63770142

Frequently Asked Questions

What is the IUPAC name of 2-(4-cyanopiperidin-1-yl)-N-(2,5-dichlorophenyl)acetamide?
The IUPAC name of 2-(4-cyanopiperidin-1-yl)-N-(2,5-dichlorophenyl)acetamide (CID 48940747) is 2-(4-cyanopiperidin-1-yl)-N-(2,5-dichlorophenyl)acetamide.
What is the SMILES notation for 2-(4-cyanopiperidin-1-yl)-N-(2,5-dichlorophenyl)acetamide?
The canonical SMILES for 2-(4-cyanopiperidin-1-yl)-N-(2,5-dichlorophenyl)acetamide is N#CC1CCN(CC(=O)Nc2cc(Cl)ccc2Cl)CC1.
What is the InChIKey of 2-(4-cyanopiperidin-1-yl)-N-(2,5-dichlorophenyl)acetamide?
The InChIKey is CGPOGMCQGJBRBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15Cl2N3O/c15-11-1-2-12(16)13(7-11)18-14(20)9-19-5-3-10(8-17)4-6-19/h1-2,7,10H,3-6,9H2,(H,18,20).
What are the key properties of 2-(4-cyanopiperidin-1-yl)-N-(2,5-dichlorophenyl)acetamide?
2-(4-cyanopiperidin-1-yl)-N-(2,5-dichlorophenyl)acetamide has a molecular weight of 312.20 g/mol, XLogP of 3.17, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyanopiperidin-1-yl)-N-(2,5-dichlorophenyl)acetamide is sourced from PubChem (CID 48940747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).