methyl 2-methyl-3-[methyl(pyrrolidine-2-carbonyl)amino]propanoate

C11H20N2O3 — CID 60963906

IUPACmethyl 2-methyl-3-[methyl(pyrrolidine-2-carbonyl)amino]propanoate
SMILESCOC(=O)C(C)CN(C)C(=O)C1CCCN1
InChIInChI=1S/C11H20N2O3/c1-8(11(15)16-3)7-13(2)10(14)9-5-4-6-12-9/h8-9,12H,4-7H2,1-3H3
InChIKeyYDSLIGXLXTYDGM-UHFFFAOYSA-N
MW228.29 g/mol
LogP0.01
Rot. Bonds4

About methyl 2-methyl-3-[methyl(pyrrolidine-2-carbonyl)amino]propanoate

methyl 2-methyl-3-[methyl(pyrrolidine-2-carbonyl)amino]propanoate (PubChem CID 60963906) has the molecular formula C11H20N2O3 and a molecular weight of 228.29 g/mol. Its IUPAC name is methyl 2-methyl-3-[methyl(pyrrolidine-2-carbonyl)amino]propanoate.

Molecular Properties

Compound Namemethyl 2-methyl-3-[methyl(pyrrolidine-2-carbonyl)amino]propanoate
PubChem CID60963906
Molecular FormulaC11H20N2O3
Molecular Weight228.29 g/mol
Exact Mass228.15
IUPAC Namemethyl 2-methyl-3-[methyl(pyrrolidine-2-carbonyl)amino]propanoate
SMILESCOC(=O)C(C)CN(C)C(=O)C1CCCN1
InChIInChI=1S/C11H20N2O3/c1-8(11(15)16-3)7-13(2)10(14)9-5-4-6-12-9/h8-9,12H,4-7H2,1-3H3
InChIKeyYDSLIGXLXTYDGM-UHFFFAOYSA-N
XLogP0.01
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
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

(2S)-N-methyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]piperidine-2-carboxamide;hydrochloride
CID 119818675
methyl 2-methyl-3-[methyl-(2-oxo-1,3-thiazolidine-4-carbonyl)amino]propanoate
CID 55008549
(2R)-N-(2,2-difluoroethyl)-N-methylpiperidine-2-carboxamide
CID 103809890
methyl 2-[propan-2-yl(pyrrolidine-2-carbonyl)amino]acetate
CID 60947765
N-methyl-N-(2-propan-2-yloxyethyl)pyrrolidine-2-carboxamide
CID 80710136
(2S)-N-(2-methoxyethyl)-N-methylpyrrolidine-2-carboxamide;hydrochloride
CID 68805915
methyl 2-methyl-3-[methyl-(3-methylpiperidine-4-carbonyl)amino]propanoate
CID 114278839
methyl 2-methyl-3-[methyl(1,2,3,4-tetrahydroisoquinoline-3-carbonyl)amino]propanoate
CID 60963908
N-[2-[methoxy(methyl)amino]-2-oxoethyl]-N-methylpyrrolidine-2-carboxamide
CID 141072279
(2R)-N-(3-methoxypropyl)-N-methylpyrrolidine-2-carboxamide
CID 94912304
methyl 3-[(2,2-dimethylcyclopentanecarbonyl)-methylamino]-2-methylpropanoate
CID 104919723
N-(2-cyanopropyl)-N-methylazepane-2-carboxamide
CID 64563051

Frequently Asked Questions

What is the IUPAC name of methyl 2-methyl-3-[methyl(pyrrolidine-2-carbonyl)amino]propanoate?
The IUPAC name of methyl 2-methyl-3-[methyl(pyrrolidine-2-carbonyl)amino]propanoate (CID 60963906) is methyl 2-methyl-3-[methyl(pyrrolidine-2-carbonyl)amino]propanoate.
What is the SMILES notation for methyl 2-methyl-3-[methyl(pyrrolidine-2-carbonyl)amino]propanoate?
The canonical SMILES for methyl 2-methyl-3-[methyl(pyrrolidine-2-carbonyl)amino]propanoate is COC(=O)C(C)CN(C)C(=O)C1CCCN1.
What is the InChIKey of methyl 2-methyl-3-[methyl(pyrrolidine-2-carbonyl)amino]propanoate?
The InChIKey is YDSLIGXLXTYDGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3/c1-8(11(15)16-3)7-13(2)10(14)9-5-4-6-12-9/h8-9,12H,4-7H2,1-3H3.
What are the key properties of methyl 2-methyl-3-[methyl(pyrrolidine-2-carbonyl)amino]propanoate?
methyl 2-methyl-3-[methyl(pyrrolidine-2-carbonyl)amino]propanoate has a molecular weight of 228.29 g/mol, XLogP of 0.01, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-methyl-3-[methyl(pyrrolidine-2-carbonyl)amino]propanoate is sourced from PubChem (CID 60963906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).