N-(3-chlorophenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide

C14H20ClN3O — CID 62545829

IUPACN-(3-chlorophenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide
SMILESCNC1CCCN(CC(=O)Nc2cccc(Cl)c2)C1
InChIInChI=1S/C14H20ClN3O/c1-16-13-6-3-7-18(9-13)10-14(19)17-12-5-2-4-11(15)8-12/h2,4-5,8,13,16H,3,6-7,9-10H2,1H3,(H,17,19)
InChIKeyGMZOMSLSBMSNCP-UHFFFAOYSA-N
MW281.79 g/mol
LogP1.96
Rot. Bonds4

About N-(3-chlorophenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide

N-(3-chlorophenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide (PubChem CID 62545829) has the molecular formula C14H20ClN3O and a molecular weight of 281.79 g/mol. Its IUPAC name is N-(3-chlorophenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide
PubChem CID62545829
Molecular FormulaC14H20ClN3O
Molecular Weight281.79 g/mol
Exact Mass281.13
IUPAC NameN-(3-chlorophenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide
SMILESCNC1CCCN(CC(=O)Nc2cccc(Cl)c2)C1
InChIInChI=1S/C14H20ClN3O/c1-16-13-6-3-7-18(9-13)10-14(19)17-12-5-2-4-11(15)8-12/h2,4-5,8,13,16H,3,6-7,9-10H2,1H3,(H,17,19)
InChIKeyGMZOMSLSBMSNCP-UHFFFAOYSA-N
XLogP1.96
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.79
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-iodophenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide;hydrochloride
CID 119919334
N-(3,4-dichlorophenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide
CID 62545984
N-(2,5-dichlorophenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide
CID 62545625
N-(3-chlorophenyl)-2-pyrrolidin-1-ylacetamide;hydrochloride
CID 2917131
2-[3-(methylamino)piperidin-1-yl]-N-[3-(trifluoromethyl)phenyl]acetamide;hydrochloride
CID 119920212
N-(3-chlorophenyl)-2-[(3S)-3-(pyrrolidine-1-carbonyl)piperidin-1-yl]acetamide
CID 95622494
2-[3-(methylamino)piperidin-1-yl]-N-pyridin-4-ylacetamide
CID 119918337
2-[3-(2-aminoethyl)piperidin-1-yl]-N-(3-chlorophenyl)acetamide;hydrochloride
CID 120728109
N-(2-chlorophenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide
CID 62546007
2-[3-(methylamino)piperidin-1-yl]-N-pyridin-4-ylacetamide;dihydrochloride
CID 119918336
N-(4-chlorophenyl)-2-[3-(methylamino)pyrrolidin-1-yl]acetamide
CID 81493727
N-(3-acetylphenyl)-2-[3-(methylamino)pyrrolidin-1-yl]acetamide
CID 81493231

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide?
The IUPAC name of N-(3-chlorophenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide (CID 62545829) is N-(3-chlorophenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide.
What is the SMILES notation for N-(3-chlorophenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide?
The canonical SMILES for N-(3-chlorophenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide is CNC1CCCN(CC(=O)Nc2cccc(Cl)c2)C1.
What is the InChIKey of N-(3-chlorophenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide?
The InChIKey is GMZOMSLSBMSNCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20ClN3O/c1-16-13-6-3-7-18(9-13)10-14(19)17-12-5-2-4-11(15)8-12/h2,4-5,8,13,16H,3,6-7,9-10H2,1H3,(H,17,19).
What are the key properties of N-(3-chlorophenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide?
N-(3-chlorophenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide has a molecular weight of 281.79 g/mol, XLogP of 1.96, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide is sourced from PubChem (CID 62545829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).