N-(3-chloro-5-fluorophenyl)-2-piperidin-3-ylacetamide

C13H16ClFN2O — CID 107365833

IUPACN-(3-chloro-5-fluorophenyl)-2-piperidin-3-ylacetamide
SMILESO=C(CC1CCCNC1)Nc1cc(F)cc(Cl)c1
InChIInChI=1S/C13H16ClFN2O/c14-10-5-11(15)7-12(6-10)17-13(18)4-9-2-1-3-16-8-9/h5-7,9,16H,1-4,8H2,(H,17,18)
InChIKeyKVVQAVBQCOJBPE-UHFFFAOYSA-N
MW270.73 g/mol
LogP2.81
Rot. Bonds3

About N-(3-chloro-5-fluorophenyl)-2-piperidin-3-ylacetamide

N-(3-chloro-5-fluorophenyl)-2-piperidin-3-ylacetamide (PubChem CID 107365833) has the molecular formula C13H16ClFN2O and a molecular weight of 270.73 g/mol. Its IUPAC name is N-(3-chloro-5-fluorophenyl)-2-piperidin-3-ylacetamide.

Molecular Properties

Compound NameN-(3-chloro-5-fluorophenyl)-2-piperidin-3-ylacetamide
PubChem CID107365833
Molecular FormulaC13H16ClFN2O
Molecular Weight270.73 g/mol
Exact Mass270.09
IUPAC NameN-(3-chloro-5-fluorophenyl)-2-piperidin-3-ylacetamide
SMILESO=C(CC1CCCNC1)Nc1cc(F)cc(Cl)c1
InChIInChI=1S/C13H16ClFN2O/c14-10-5-11(15)7-12(6-10)17-13(18)4-9-2-1-3-16-8-9/h5-7,9,16H,1-4,8H2,(H,17,18)
InChIKeyKVVQAVBQCOJBPE-UHFFFAOYSA-N
XLogP2.81
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.73
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[3-chloro-5-(trifluoromethyl)phenyl]-2-piperidin-3-ylacetamide
CID 116699598
N-(2-chloro-4-fluorophenyl)-2-piperidin-3-ylacetamide
CID 62676653
N-(3-chloro-5-fluorophenyl)pyrrolidine-3-carboxamide
CID 107365750
N-(3,5-difluorophenyl)-2-[methyl(piperidin-3-ylmethyl)amino]acetamide;hydrochloride
CID 119931387
N-[3-chloro-4-(difluoromethoxy)phenyl]-2-piperidin-3-ylacetamide
CID 62675986
N-(2-chloro-5-iodophenyl)-2-piperidin-3-ylacetamide
CID 114259816
N-(3-chloro-5-fluorophenyl)-2-(1,4-diazepan-1-yl)acetamide
CID 107365899
methyl 2-chloro-5-[(2-piperidin-3-ylacetyl)amino]benzoate
CID 62676837
(2R)-N-(3-chloro-5-fluorophenyl)pyrrolidine-2-carboxamide
CID 107365936
4-fluoro-2-[(2-piperidin-3-ylacetyl)amino]benzoic acid
CID 62675630
4-chloro-3-[(2-piperidin-3-ylacetyl)amino]benzoic acid
CID 62675976
N-(4-tert-butylphenyl)-2-piperidin-3-ylacetamide
CID 62690880

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-5-fluorophenyl)-2-piperidin-3-ylacetamide?
The IUPAC name of N-(3-chloro-5-fluorophenyl)-2-piperidin-3-ylacetamide (CID 107365833) is N-(3-chloro-5-fluorophenyl)-2-piperidin-3-ylacetamide.
What is the SMILES notation for N-(3-chloro-5-fluorophenyl)-2-piperidin-3-ylacetamide?
The canonical SMILES for N-(3-chloro-5-fluorophenyl)-2-piperidin-3-ylacetamide is O=C(CC1CCCNC1)Nc1cc(F)cc(Cl)c1.
What is the InChIKey of N-(3-chloro-5-fluorophenyl)-2-piperidin-3-ylacetamide?
The InChIKey is KVVQAVBQCOJBPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16ClFN2O/c14-10-5-11(15)7-12(6-10)17-13(18)4-9-2-1-3-16-8-9/h5-7,9,16H,1-4,8H2,(H,17,18).
What are the key properties of N-(3-chloro-5-fluorophenyl)-2-piperidin-3-ylacetamide?
N-(3-chloro-5-fluorophenyl)-2-piperidin-3-ylacetamide has a molecular weight of 270.73 g/mol, XLogP of 2.81, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-5-fluorophenyl)-2-piperidin-3-ylacetamide is sourced from PubChem (CID 107365833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).