methyl 2-[methyl-(3-methylpiperidine-3-carbonyl)amino]acetate

C11H20N2O3 — CID 63131941

IUPACmethyl 2-[methyl-(3-methylpiperidine-3-carbonyl)amino]acetate
SMILESCOC(=O)CN(C)C(=O)C1(C)CCCNC1
InChIInChI=1S/C11H20N2O3/c1-11(5-4-6-12-8-11)10(15)13(2)7-9(14)16-3/h12H,4-8H2,1-3H3
InChIKeyNHMVLHVSKGRRGQ-UHFFFAOYSA-N
MW228.29 g/mol
LogP0.01
Rot. Bonds3

About methyl 2-[methyl-(3-methylpiperidine-3-carbonyl)amino]acetate

methyl 2-[methyl-(3-methylpiperidine-3-carbonyl)amino]acetate (PubChem CID 63131941) has the molecular formula C11H20N2O3 and a molecular weight of 228.29 g/mol. Its IUPAC name is methyl 2-[methyl-(3-methylpiperidine-3-carbonyl)amino]acetate.

Molecular Properties

Compound Namemethyl 2-[methyl-(3-methylpiperidine-3-carbonyl)amino]acetate
PubChem CID63131941
Molecular FormulaC11H20N2O3
Molecular Weight228.29 g/mol
Exact Mass228.15
IUPAC Namemethyl 2-[methyl-(3-methylpiperidine-3-carbonyl)amino]acetate
SMILESCOC(=O)CN(C)C(=O)C1(C)CCCNC1
InChIInChI=1S/C11H20N2O3/c1-11(5-4-6-12-8-11)10(15)13(2)7-9(14)16-3/h12H,4-8H2,1-3H3
InChIKeyNHMVLHVSKGRRGQ-UHFFFAOYSA-N
XLogP0.01
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 50.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N,3-dimethyl-N-[2-(methylamino)-2-oxoethyl]piperidine-3-carboxamide
CID 63130187
methyl 4-[methyl-(3-methylpyrrolidine-3-carbonyl)amino]butanoate
CID 63143846
N-(2-hydroxy-2-methylpropyl)-N,3-dimethylpiperidine-3-carboxamide
CID 79377525
N-(2-anilino-2-oxoethyl)-N,3-dimethylpiperidine-3-carboxamide
CID 63131670
methyl 2-[(3-methylpyrrolidine-3-carbonyl)-propylamino]acetate
CID 63143757
methyl 2-[methyl-(3-propylpyrrolidine-3-carbonyl)amino]acetate
CID 63143463
methyl (3S)-3-methylpiperidine-3-carboxylate
CID 52644166
N,N-bis(2-methoxyethyl)-3-methylpiperidine-3-carboxamide
CID 63130592
N-[2-(4-methoxyphenoxy)ethyl]-N,3-dimethylpiperidine-3-carboxamide
CID 119943919
N-cyclobutyl-N,3-dimethylpiperidine-3-carboxamide
CID 115747528
N-[(4-ethylphenyl)methyl]-N,3-dimethylpiperidine-3-carboxamide;hydrochloride
CID 119943770
ethyl 2-[cyclopropyl-(3-methylpiperidine-3-carbonyl)amino]acetate
CID 63131815

Frequently Asked Questions

What is the IUPAC name of methyl 2-[methyl-(3-methylpiperidine-3-carbonyl)amino]acetate?
The IUPAC name of methyl 2-[methyl-(3-methylpiperidine-3-carbonyl)amino]acetate (CID 63131941) is methyl 2-[methyl-(3-methylpiperidine-3-carbonyl)amino]acetate.
What is the SMILES notation for methyl 2-[methyl-(3-methylpiperidine-3-carbonyl)amino]acetate?
The canonical SMILES for methyl 2-[methyl-(3-methylpiperidine-3-carbonyl)amino]acetate is COC(=O)CN(C)C(=O)C1(C)CCCNC1.
What is the InChIKey of methyl 2-[methyl-(3-methylpiperidine-3-carbonyl)amino]acetate?
The InChIKey is NHMVLHVSKGRRGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3/c1-11(5-4-6-12-8-11)10(15)13(2)7-9(14)16-3/h12H,4-8H2,1-3H3.
What are the key properties of methyl 2-[methyl-(3-methylpiperidine-3-carbonyl)amino]acetate?
methyl 2-[methyl-(3-methylpiperidine-3-carbonyl)amino]acetate has a molecular weight of 228.29 g/mol, XLogP of 0.01, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[methyl-(3-methylpiperidine-3-carbonyl)amino]acetate is sourced from PubChem (CID 63131941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).