methyl (2R)-2-[(3-methylpyrrolidine-3-carbonyl)amino]propanoate

C10H18N2O3 — CID 119781278

IUPACmethyl (2R)-2-[(3-methylpyrrolidine-3-carbonyl)amino]propanoate
SMILESCOC(=O)[C@@H](C)NC(=O)C1(C)CCNC1
InChIInChI=1S/C10H18N2O3/c1-7(8(13)15-3)12-9(14)10(2)4-5-11-6-10/h7,11H,4-6H2,1-3H3,(H,12,14)/t7-,10?/m1/s1
InChIKeyUJLWNGHQNLNHCU-PVSHWOEXSA-N
MW214.26 g/mol
LogP-0.34
Rot. Bonds3

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

methyl (2R)-2-[(3-methylpyrrolidine-3-carbonyl)amino]propanoate (PubChem CID 119781278) has the molecular formula C10H18N2O3 and a molecular weight of 214.26 g/mol. Its IUPAC name is methyl (2R)-2-[(3-methylpyrrolidine-3-carbonyl)amino]propanoate.

Molecular Properties

Compound Namemethyl (2R)-2-[(3-methylpyrrolidine-3-carbonyl)amino]propanoate
PubChem CID119781278
Molecular FormulaC10H18N2O3
Molecular Weight214.26 g/mol
Exact Mass214.13
IUPAC Namemethyl (2R)-2-[(3-methylpyrrolidine-3-carbonyl)amino]propanoate
SMILESCOC(=O)[C@@H](C)NC(=O)C1(C)CCNC1
InChIInChI=1S/C10H18N2O3/c1-7(8(13)15-3)12-9(14)10(2)4-5-11-6-10/h7,11H,4-6H2,1-3H3,(H,12,14)/t7-,10?/m1/s1
InChIKeyUJLWNGHQNLNHCU-PVSHWOEXSA-N
XLogP-0.34
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 5-0.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze methyl (2R)-2-[(3-methylpyrrolidine-3-carbonyl)amino]propanoate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

methyl 2-[(1-methylcyclohexanecarbonyl)amino]propanoate
CID 106828162
N-[1-(tert-butylamino)-1-oxopropan-2-yl]-3-methylpyrrolidine-3-carboxamide
CID 113266401
N-(3,3-dimethylbutan-2-yl)-3-methylpyrrolidine-3-carboxamide
CID 104828260
N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-3-methylpyrrolidine-3-carboxamide
CID 103109036
methyl 2-[(3-propylpyrrolidine-3-carbonyl)amino]propanoate
CID 63142586
methyl 2-hydroxy-3-[(3-methylpyrrolidine-3-carbonyl)amino]propanoate
CID 107222737
3-methyl-N-(1-morpholin-4-yl-1-oxopropan-2-yl)pyrrolidine-3-carboxamide
CID 112701745
N-(1-ethoxypropan-2-yl)-3-methylpyrrolidine-3-carboxamide
CID 63142112
3-methyl-N-(1-methylsulfanylpropan-2-yl)pyrrolidine-3-carboxamide;hydrochloride
CID 119796250
N-[(1R)-1-cyclopentylethyl]-3-methylpyrrolidine-3-carboxamide
CID 81388379
methyl (3S)-3-methylpyrrolidine-3-carboxylate
CID 95020716
N-[1-(3,4-dimethoxyphenyl)ethyl]-3-methylpyrrolidine-3-carboxamide;hydrochloride
CID 119720011

Frequently Asked Questions

What is the IUPAC name of methyl (2R)-2-[(3-methylpyrrolidine-3-carbonyl)amino]propanoate?
The IUPAC name of methyl (2R)-2-[(3-methylpyrrolidine-3-carbonyl)amino]propanoate (CID 119781278) is methyl (2R)-2-[(3-methylpyrrolidine-3-carbonyl)amino]propanoate.
What is the SMILES notation for methyl (2R)-2-[(3-methylpyrrolidine-3-carbonyl)amino]propanoate?
The canonical SMILES for methyl (2R)-2-[(3-methylpyrrolidine-3-carbonyl)amino]propanoate is COC(=O)[C@@H](C)NC(=O)C1(C)CCNC1.
What is the InChIKey of methyl (2R)-2-[(3-methylpyrrolidine-3-carbonyl)amino]propanoate?
The InChIKey is UJLWNGHQNLNHCU-PVSHWOEXSA-N. The full InChI is InChI=1S/C10H18N2O3/c1-7(8(13)15-3)12-9(14)10(2)4-5-11-6-10/h7,11H,4-6H2,1-3H3,(H,12,14)/t7-,10?/m1/s1.
What are the key properties of methyl (2R)-2-[(3-methylpyrrolidine-3-carbonyl)amino]propanoate?
methyl (2R)-2-[(3-methylpyrrolidine-3-carbonyl)amino]propanoate has a molecular weight of 214.26 g/mol, XLogP of -0.34, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl (2R)-2-[(3-methylpyrrolidine-3-carbonyl)amino]propanoate is sourced from PubChem (CID 119781278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).