N-methyl-N-(1-methylpiperidin-3-yl)-2-oxopropanamide

C10H18N2O2 — CID 115175567

IUPACN-methyl-N-(1-methylpiperidin-3-yl)-2-oxopropanamide
SMILESCC(=O)C(=O)N(C)C1CCCN(C)C1
InChIInChI=1S/C10H18N2O2/c1-8(13)10(14)12(3)9-5-4-6-11(2)7-9/h9H,4-7H2,1-3H3
InChIKeyULGJUFOWRUNKJO-UHFFFAOYSA-N
MW198.27 g/mol
LogP0.13
Rot. Bonds2

About N-methyl-N-(1-methylpiperidin-3-yl)-2-oxopropanamide

N-methyl-N-(1-methylpiperidin-3-yl)-2-oxopropanamide (PubChem CID 115175567) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is N-methyl-N-(1-methylpiperidin-3-yl)-2-oxopropanamide.

Molecular Properties

Compound NameN-methyl-N-(1-methylpiperidin-3-yl)-2-oxopropanamide
PubChem CID115175567
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC NameN-methyl-N-(1-methylpiperidin-3-yl)-2-oxopropanamide
SMILESCC(=O)C(=O)N(C)C1CCCN(C)C1
InChIInChI=1S/C10H18N2O2/c1-8(13)10(14)12(3)9-5-4-6-11(2)7-9/h9H,4-7H2,1-3H3
InChIKeyULGJUFOWRUNKJO-UHFFFAOYSA-N
XLogP0.13
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 50.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

1-methyl-1-(1-methylpiperidin-3-yl)urea
CID 62546065
2-amino-N-methyl-N-[(3S)-1-methylpiperidin-3-yl]acetamide
CID 66565804
2-bromo-N,2-dimethyl-N-(1-methylpiperidin-3-yl)propanamide
CID 114328609
N-methyl-N-(1-methylpiperidin-3-yl)but-2-enamide
CID 79005735
N-cyclohexyl-N-methyl-2-oxopropanamide
CID 115175558
3-amino-N-methyl-N-(1-methylpiperidin-3-yl)cyclobutane-1-carboxamide
CID 115161473
2,2-dimethyl-3-[methyl-(1-methylpiperidin-3-yl)amino]-3-oxopropanoic acid
CID 82820537
2-[methyl-(1-methylpiperidin-3-yl)carbamoyl]cyclopentane-1-carboxylic acid
CID 103978705
2-amino-N-methyl-N-(1-methylpiperidin-3-yl)cyclopentane-1-carboxamide
CID 64824632
1-methyl-1-(1-methylpiperidin-3-yl)-3-propylurea
CID 116655563
2-(azetidin-3-yl)-N-methyl-N-(1-methylpiperidin-3-yl)acetamide
CID 64610616
N-methyl-N-(1-methylpiperidin-3-yl)pyrrolidine-2-carboxamide
CID 62546250

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(1-methylpiperidin-3-yl)-2-oxopropanamide?
The IUPAC name of N-methyl-N-(1-methylpiperidin-3-yl)-2-oxopropanamide (CID 115175567) is N-methyl-N-(1-methylpiperidin-3-yl)-2-oxopropanamide.
What is the SMILES notation for N-methyl-N-(1-methylpiperidin-3-yl)-2-oxopropanamide?
The canonical SMILES for N-methyl-N-(1-methylpiperidin-3-yl)-2-oxopropanamide is CC(=O)C(=O)N(C)C1CCCN(C)C1.
What is the InChIKey of N-methyl-N-(1-methylpiperidin-3-yl)-2-oxopropanamide?
The InChIKey is ULGJUFOWRUNKJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2/c1-8(13)10(14)12(3)9-5-4-6-11(2)7-9/h9H,4-7H2,1-3H3.
What are the key properties of N-methyl-N-(1-methylpiperidin-3-yl)-2-oxopropanamide?
N-methyl-N-(1-methylpiperidin-3-yl)-2-oxopropanamide has a molecular weight of 198.27 g/mol, XLogP of 0.13, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(1-methylpiperidin-3-yl)-2-oxopropanamide is sourced from PubChem (CID 115175567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).