N-(4-methylphenyl)-2-[methyl(piperidin-3-ylmethyl)amino]acetamide

C16H25N3O — CID 103815598

IUPACN-(4-methylphenyl)-2-[methyl(piperidin-3-ylmethyl)amino]acetamide
SMILESCc1ccc(NC(=O)CN(C)CC2CCCNC2)cc1
InChIInChI=1S/C16H25N3O/c1-13-5-7-15(8-6-13)18-16(20)12-19(2)11-14-4-3-9-17-10-14/h5-8,14,17H,3-4,9-12H2,1-2H3,(H,18,20)
InChIKeyOVVDDXIPFNOPMT-UHFFFAOYSA-N
MW275.40 g/mol
LogP1.86
Rot. Bonds5

About N-(4-methylphenyl)-2-[methyl(piperidin-3-ylmethyl)amino]acetamide

N-(4-methylphenyl)-2-[methyl(piperidin-3-ylmethyl)amino]acetamide (PubChem CID 103815598) has the molecular formula C16H25N3O and a molecular weight of 275.40 g/mol. Its IUPAC name is N-(4-methylphenyl)-2-[methyl(piperidin-3-ylmethyl)amino]acetamide.

Molecular Properties

Compound NameN-(4-methylphenyl)-2-[methyl(piperidin-3-ylmethyl)amino]acetamide
PubChem CID103815598
Molecular FormulaC16H25N3O
Molecular Weight275.40 g/mol
Exact Mass275.20
IUPAC NameN-(4-methylphenyl)-2-[methyl(piperidin-3-ylmethyl)amino]acetamide
SMILESCc1ccc(NC(=O)CN(C)CC2CCCNC2)cc1
InChIInChI=1S/C16H25N3O/c1-13-5-7-15(8-6-13)18-16(20)12-19(2)11-14-4-3-9-17-10-14/h5-8,14,17H,3-4,9-12H2,1-2H3,(H,18,20)
InChIKeyOVVDDXIPFNOPMT-UHFFFAOYSA-N
XLogP1.86
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3,4-dichlorophenyl)-2-[methyl(piperidin-3-ylmethyl)amino]acetamide
CID 103815619
N-(2,6-dimethylphenyl)-2-[methyl(piperidin-3-ylmethyl)amino]acetamide
CID 103815623
N-(3,5-difluorophenyl)-2-[methyl(piperidin-3-ylmethyl)amino]acetamide;hydrochloride
CID 119931387
N-(4-acetamidophenyl)-2-[ethyl(piperidin-3-ylmethyl)amino]acetamide
CID 119929411
2-[methyl(piperidin-3-ylmethyl)amino]-N-(2-methylsulfanylphenyl)acetamide;hydrochloride
CID 119929541
2-[[2-[methyl(piperidin-3-ylmethyl)amino]acetyl]amino]thiophene-3-carboxamide
CID 106637147
N-(4-methylphenyl)-2-[methyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride
CID 119922897
N-cyclohexyl-2-[methyl(piperidin-3-ylmethyl)amino]acetamide
CID 106636311
N,N-dimethyl-4-[(2-piperidin-3-ylacetyl)amino]benzamide
CID 62676306
N-cyclopentyl-2-[methyl-[2-(4-methylanilino)-2-oxoethyl]amino]acetamide
CID 27171227
N-(2-methylbutan-2-yl)-2-[methyl(piperidin-3-ylmethyl)amino]acetamide
CID 106636496
N-(4-tert-butylphenyl)-2-piperidin-3-ylacetamide
CID 62690880

Frequently Asked Questions

What is the IUPAC name of N-(4-methylphenyl)-2-[methyl(piperidin-3-ylmethyl)amino]acetamide?
The IUPAC name of N-(4-methylphenyl)-2-[methyl(piperidin-3-ylmethyl)amino]acetamide (CID 103815598) is N-(4-methylphenyl)-2-[methyl(piperidin-3-ylmethyl)amino]acetamide.
What is the SMILES notation for N-(4-methylphenyl)-2-[methyl(piperidin-3-ylmethyl)amino]acetamide?
The canonical SMILES for N-(4-methylphenyl)-2-[methyl(piperidin-3-ylmethyl)amino]acetamide is Cc1ccc(NC(=O)CN(C)CC2CCCNC2)cc1.
What is the InChIKey of N-(4-methylphenyl)-2-[methyl(piperidin-3-ylmethyl)amino]acetamide?
The InChIKey is OVVDDXIPFNOPMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-13-5-7-15(8-6-13)18-16(20)12-19(2)11-14-4-3-9-17-10-14/h5-8,14,17H,3-4,9-12H2,1-2H3,(H,18,20).
What are the key properties of N-(4-methylphenyl)-2-[methyl(piperidin-3-ylmethyl)amino]acetamide?
N-(4-methylphenyl)-2-[methyl(piperidin-3-ylmethyl)amino]acetamide has a molecular weight of 275.40 g/mol, XLogP of 1.86, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylphenyl)-2-[methyl(piperidin-3-ylmethyl)amino]acetamide is sourced from PubChem (CID 103815598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).