N-methyl-2-(methylamino)-N-[(4-piperidin-1-ylphenyl)methyl]acetamide

C16H25N3O — CID 61254195

IUPACN-methyl-2-(methylamino)-N-[(4-piperidin-1-ylphenyl)methyl]acetamide
SMILESCNCC(=O)N(C)Cc1ccc(N2CCCCC2)cc1
InChIInChI=1S/C16H25N3O/c1-17-12-16(20)18(2)13-14-6-8-15(9-7-14)19-10-4-3-5-11-19/h6-9,17H,3-5,10-13H2,1-2H3
InChIKeyWQAJGZDBPDEFDA-UHFFFAOYSA-N
MW275.40 g/mol
LogP1.85
Rot. Bonds5

About N-methyl-2-(methylamino)-N-[(4-piperidin-1-ylphenyl)methyl]acetamide

N-methyl-2-(methylamino)-N-[(4-piperidin-1-ylphenyl)methyl]acetamide (PubChem CID 61254195) has the molecular formula C16H25N3O and a molecular weight of 275.40 g/mol. Its IUPAC name is N-methyl-2-(methylamino)-N-[(4-piperidin-1-ylphenyl)methyl]acetamide.

Molecular Properties

Compound NameN-methyl-2-(methylamino)-N-[(4-piperidin-1-ylphenyl)methyl]acetamide
PubChem CID61254195
Molecular FormulaC16H25N3O
Molecular Weight275.40 g/mol
Exact Mass275.20
IUPAC NameN-methyl-2-(methylamino)-N-[(4-piperidin-1-ylphenyl)methyl]acetamide
SMILESCNCC(=O)N(C)Cc1ccc(N2CCCCC2)cc1
InChIInChI=1S/C16H25N3O/c1-17-12-16(20)18(2)13-14-6-8-15(9-7-14)19-10-4-3-5-11-19/h6-9,17H,3-5,10-13H2,1-2H3
InChIKeyWQAJGZDBPDEFDA-UHFFFAOYSA-N
XLogP1.85
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_D(198)', 'substructure': 'N/A'}, {'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

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Related Compounds

3-[methyl-[(4-piperidin-1-ylphenyl)methyl]amino]-3-oxopropanoic acid
CID 62231414
N-methyl-3-oxo-N-[(4-piperidin-1-ylphenyl)methyl]butanamide
CID 18072731
3,5-dimethyl-N-[2-[methyl-[(4-piperidin-1-ylphenyl)methyl]amino]-2-oxoethyl]benzamide
CID 24551977
6-acetamido-N-methyl-N-[(4-piperidin-1-ylphenyl)methyl]hexanamide
CID 39490122
N-methyl-2-(4-nitrophenyl)-N-[(4-piperidin-1-ylphenyl)methyl]acetamide
CID 34470185
2-amino-N-methyl-N-[(4-piperidin-1-ylphenyl)methyl]butanamide
CID 61254395
3-cyclopentylsulfonyl-N-methyl-N-[(4-piperidin-1-ylphenyl)methyl]propanamide
CID 47040746
N-methyl-N-[(4-piperidin-1-ylphenyl)methyl]-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]acetamide
CID 55416151
2-[[ethylamino-[methyl-[(4-piperidin-1-ylphenyl)methyl]amino]methylidene]amino]-N,N-dimethylacetamide
CID 111414530
3-[(4-chlorophenyl)sulfonylamino]-N-methyl-N-[(4-piperidin-1-ylphenyl)methyl]propanamide
CID 24552043
N-methyl-2-(methylamino)-N-(pyridin-4-ylmethyl)acetamide
CID 43564524
N-methyl-N-[(4-piperidin-1-ylphenyl)methyl]-2-(4-propanoylphenoxy)acetamide
CID 55416112

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(methylamino)-N-[(4-piperidin-1-ylphenyl)methyl]acetamide?
The IUPAC name of N-methyl-2-(methylamino)-N-[(4-piperidin-1-ylphenyl)methyl]acetamide (CID 61254195) is N-methyl-2-(methylamino)-N-[(4-piperidin-1-ylphenyl)methyl]acetamide.
What is the SMILES notation for N-methyl-2-(methylamino)-N-[(4-piperidin-1-ylphenyl)methyl]acetamide?
The canonical SMILES for N-methyl-2-(methylamino)-N-[(4-piperidin-1-ylphenyl)methyl]acetamide is CNCC(=O)N(C)Cc1ccc(N2CCCCC2)cc1.
What is the InChIKey of N-methyl-2-(methylamino)-N-[(4-piperidin-1-ylphenyl)methyl]acetamide?
The InChIKey is WQAJGZDBPDEFDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-17-12-16(20)18(2)13-14-6-8-15(9-7-14)19-10-4-3-5-11-19/h6-9,17H,3-5,10-13H2,1-2H3.
What are the key properties of N-methyl-2-(methylamino)-N-[(4-piperidin-1-ylphenyl)methyl]acetamide?
N-methyl-2-(methylamino)-N-[(4-piperidin-1-ylphenyl)methyl]acetamide has a molecular weight of 275.40 g/mol, XLogP of 1.85, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(methylamino)-N-[(4-piperidin-1-ylphenyl)methyl]acetamide is sourced from PubChem (CID 61254195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).