N-(2-chloro-4-methylphenyl)-2-[ethyl(piperidin-3-yl)amino]acetamide

C16H24ClN3O — CID 63637830

IUPACN-(2-chloro-4-methylphenyl)-2-[ethyl(piperidin-3-yl)amino]acetamide
SMILESCCN(CC(=O)Nc1ccc(C)cc1Cl)C1CCCNC1
InChIInChI=1S/C16H24ClN3O/c1-3-20(13-5-4-8-18-10-13)11-16(21)19-15-7-6-12(2)9-14(15)17/h6-7,9,13,18H,3-5,8,10-11H2,1-2H3,(H,19,21)
InChIKeyFBCFGKGNRNHVIN-UHFFFAOYSA-N
MW309.84 g/mol
LogP2.66
Rot. Bonds5

About N-(2-chloro-4-methylphenyl)-2-[ethyl(piperidin-3-yl)amino]acetamide

N-(2-chloro-4-methylphenyl)-2-[ethyl(piperidin-3-yl)amino]acetamide (PubChem CID 63637830) has the molecular formula C16H24ClN3O and a molecular weight of 309.84 g/mol. Its IUPAC name is N-(2-chloro-4-methylphenyl)-2-[ethyl(piperidin-3-yl)amino]acetamide.

Molecular Properties

Compound NameN-(2-chloro-4-methylphenyl)-2-[ethyl(piperidin-3-yl)amino]acetamide
PubChem CID63637830
Molecular FormulaC16H24ClN3O
Molecular Weight309.84 g/mol
Exact Mass309.16
IUPAC NameN-(2-chloro-4-methylphenyl)-2-[ethyl(piperidin-3-yl)amino]acetamide
SMILESCCN(CC(=O)Nc1ccc(C)cc1Cl)C1CCCNC1
InChIInChI=1S/C16H24ClN3O/c1-3-20(13-5-4-8-18-10-13)11-16(21)19-15-7-6-12(2)9-14(15)17/h6-7,9,13,18H,3-5,8,10-11H2,1-2H3,(H,19,21)
InChIKeyFBCFGKGNRNHVIN-UHFFFAOYSA-N
XLogP2.66
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.84
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-bromo-2-fluorophenyl)-2-[ethyl(piperidin-3-yl)amino]acetamide
CID 63638162
N-(4-chlorophenyl)-2-[ethyl(piperidin-3-yl)amino]acetamide
CID 63638006
N-(4-chloro-2-methylphenyl)-2-[ethyl(pyrrolidin-3-yl)amino]acetamide
CID 63299906
N-(2-chloro-4-methylphenyl)-2-[methyl(piperidin-4-yl)amino]acetamide
CID 43607229
2-[ethyl(piperidin-3-yl)amino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 63637463
2-[azetidin-3-yl(ethyl)amino]-N-(2-bromo-4-methylphenyl)acetamide
CID 66183880
N-(2,5-dimethylphenyl)-2-[ethyl(piperidin-4-yl)amino]acetamide
CID 60806799
N-(2-bromo-4-methylphenyl)-2-[methyl(piperidin-3-yl)amino]acetamide
CID 63642312
N-(4-bromo-3-methylphenyl)-2-[ethyl(piperidin-3-yl)amino]acetamide
CID 63636963
2-[azetidin-3-yl(ethyl)amino]-N-(2-chlorophenyl)acetamide
CID 66183463
N-(2-bromo-4-methylphenyl)-2-[ethyl(piperidin-4-yl)amino]acetamide
CID 60807310
N-(2-chloro-3-pyridinyl)-2-[ethyl(pyrrolidin-3-yl)amino]acetamide
CID 63300131

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-4-methylphenyl)-2-[ethyl(piperidin-3-yl)amino]acetamide?
The IUPAC name of N-(2-chloro-4-methylphenyl)-2-[ethyl(piperidin-3-yl)amino]acetamide (CID 63637830) is N-(2-chloro-4-methylphenyl)-2-[ethyl(piperidin-3-yl)amino]acetamide.
What is the SMILES notation for N-(2-chloro-4-methylphenyl)-2-[ethyl(piperidin-3-yl)amino]acetamide?
The canonical SMILES for N-(2-chloro-4-methylphenyl)-2-[ethyl(piperidin-3-yl)amino]acetamide is CCN(CC(=O)Nc1ccc(C)cc1Cl)C1CCCNC1.
What is the InChIKey of N-(2-chloro-4-methylphenyl)-2-[ethyl(piperidin-3-yl)amino]acetamide?
The InChIKey is FBCFGKGNRNHVIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24ClN3O/c1-3-20(13-5-4-8-18-10-13)11-16(21)19-15-7-6-12(2)9-14(15)17/h6-7,9,13,18H,3-5,8,10-11H2,1-2H3,(H,19,21).
What are the key properties of N-(2-chloro-4-methylphenyl)-2-[ethyl(piperidin-3-yl)amino]acetamide?
N-(2-chloro-4-methylphenyl)-2-[ethyl(piperidin-3-yl)amino]acetamide has a molecular weight of 309.84 g/mol, XLogP of 2.66, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-4-methylphenyl)-2-[ethyl(piperidin-3-yl)amino]acetamide is sourced from PubChem (CID 63637830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).