N-methyl-N-[[2-[(1-methylpiperidin-4-yl)amino]phenyl]methyl]acetamide

C16H25N3O — CID 43692067

IUPACN-methyl-N-[[2-[(1-methylpiperidin-4-yl)amino]phenyl]methyl]acetamide
SMILESCC(=O)N(C)Cc1ccccc1NC1CCN(C)CC1
InChIInChI=1S/C16H25N3O/c1-13(20)19(3)12-14-6-4-5-7-16(14)17-15-8-10-18(2)11-9-15/h4-7,15,17H,8-12H2,1-3H3
InChIKeyUMLKELIUZUDUCT-UHFFFAOYSA-N
MW275.40 g/mol
LogP2.17
Rot. Bonds4

About N-methyl-N-[[2-[(1-methylpiperidin-4-yl)amino]phenyl]methyl]acetamide

N-methyl-N-[[2-[(1-methylpiperidin-4-yl)amino]phenyl]methyl]acetamide (PubChem CID 43692067) has the molecular formula C16H25N3O and a molecular weight of 275.40 g/mol. Its IUPAC name is N-methyl-N-[[2-[(1-methylpiperidin-4-yl)amino]phenyl]methyl]acetamide.

Molecular Properties

Compound NameN-methyl-N-[[2-[(1-methylpiperidin-4-yl)amino]phenyl]methyl]acetamide
PubChem CID43692067
Molecular FormulaC16H25N3O
Molecular Weight275.40 g/mol
Exact Mass275.20
IUPAC NameN-methyl-N-[[2-[(1-methylpiperidin-4-yl)amino]phenyl]methyl]acetamide
SMILESCC(=O)N(C)Cc1ccccc1NC1CCN(C)CC1
InChIInChI=1S/C16H25N3O/c1-13(20)19(3)12-14-6-4-5-7-16(14)17-15-8-10-18(2)11-9-15/h4-7,15,17H,8-12H2,1-3H3
InChIKeyUMLKELIUZUDUCT-UHFFFAOYSA-N
XLogP2.17
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[2-(cycloheptylamino)phenyl]methyl]-N-methylacetamide
CID 43692065
N-[[2-[(4-hydroxycyclohexyl)amino]phenyl]methyl]-N-methylacetamide
CID 106593826
N-[2-[(dimethylamino)methyl]phenyl]-1-methylazepan-4-amine
CID 65070089
N-methyl-N-[[2-[(3-methylcyclohexyl)amino]phenyl]methyl]acetamide
CID 43692073
N-methyl-2-[2-[(1-methylpiperidin-4-yl)amino]phenyl]acetamide
CID 43692186
N-methyl-N-[[3-[(1-methylpiperidin-4-yl)amino]phenyl]methyl]acetamide
CID 43724368
N-[2-[[acetyl(methyl)amino]methyl]phenyl]-2-(cyclopropylmethylamino)acetamide
CID 60867454
methyl 2-[(1-methylpiperidin-4-yl)amino]benzoate
CID 43139508
2-(4-aminophenyl)-N-[2-[(1-methylpiperidin-4-yl)amino]phenyl]acetamide
CID 119871528
3-amino-2-methyl-N-[2-[(1-methylpiperidin-4-yl)amino]phenyl]butanamide;dihydrochloride
CID 120503561
N-[2-[[acetyl(methyl)amino]methyl]phenyl]piperidine-4-carboxamide
CID 43704943
N-[[2-[(1-acetylpiperidin-4-yl)amino]phenyl]methyl]-N-[2-(4-hydroxyphenoxy)phenyl]acetamide
CID 143808579

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[[2-[(1-methylpiperidin-4-yl)amino]phenyl]methyl]acetamide?
The IUPAC name of N-methyl-N-[[2-[(1-methylpiperidin-4-yl)amino]phenyl]methyl]acetamide (CID 43692067) is N-methyl-N-[[2-[(1-methylpiperidin-4-yl)amino]phenyl]methyl]acetamide.
What is the SMILES notation for N-methyl-N-[[2-[(1-methylpiperidin-4-yl)amino]phenyl]methyl]acetamide?
The canonical SMILES for N-methyl-N-[[2-[(1-methylpiperidin-4-yl)amino]phenyl]methyl]acetamide is CC(=O)N(C)Cc1ccccc1NC1CCN(C)CC1.
What is the InChIKey of N-methyl-N-[[2-[(1-methylpiperidin-4-yl)amino]phenyl]methyl]acetamide?
The InChIKey is UMLKELIUZUDUCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-13(20)19(3)12-14-6-4-5-7-16(14)17-15-8-10-18(2)11-9-15/h4-7,15,17H,8-12H2,1-3H3.
What are the key properties of N-methyl-N-[[2-[(1-methylpiperidin-4-yl)amino]phenyl]methyl]acetamide?
N-methyl-N-[[2-[(1-methylpiperidin-4-yl)amino]phenyl]methyl]acetamide has a molecular weight of 275.40 g/mol, XLogP of 2.17, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[[2-[(1-methylpiperidin-4-yl)amino]phenyl]methyl]acetamide is sourced from PubChem (CID 43692067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).