methyl 2-methyl-2-[[2-(propan-2-ylamino)acetyl]amino]propanoate

C10H20N2O3 — CID 60841662

IUPACmethyl 2-methyl-2-[[2-(propan-2-ylamino)acetyl]amino]propanoate
SMILESCOC(=O)C(C)(C)NC(=O)CNC(C)C
InChIInChI=1S/C10H20N2O3/c1-7(2)11-6-8(13)12-10(3,4)9(14)15-5/h7,11H,6H2,1-5H3,(H,12,13)
InChIKeyLEYJRFJCYFRVED-UHFFFAOYSA-N
MW216.28 g/mol
LogP0.05
Rot. Bonds5

About methyl 2-methyl-2-[[2-(propan-2-ylamino)acetyl]amino]propanoate

methyl 2-methyl-2-[[2-(propan-2-ylamino)acetyl]amino]propanoate (PubChem CID 60841662) has the molecular formula C10H20N2O3 and a molecular weight of 216.28 g/mol. Its IUPAC name is methyl 2-methyl-2-[[2-(propan-2-ylamino)acetyl]amino]propanoate.

Molecular Properties

Compound Namemethyl 2-methyl-2-[[2-(propan-2-ylamino)acetyl]amino]propanoate
PubChem CID60841662
Molecular FormulaC10H20N2O3
Molecular Weight216.28 g/mol
Exact Mass216.15
IUPAC Namemethyl 2-methyl-2-[[2-(propan-2-ylamino)acetyl]amino]propanoate
SMILESCOC(=O)C(C)(C)NC(=O)CNC(C)C
InChIInChI=1S/C10H20N2O3/c1-7(2)11-6-8(13)12-10(3,4)9(14)15-5/h7,11H,6H2,1-5H3,(H,12,13)
InChIKeyLEYJRFJCYFRVED-UHFFFAOYSA-N
XLogP0.05
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-methyl-2-[4-(propan-2-ylamino)butanoylamino]propanoate
CID 60850980
N-(2-methyl-3-oxopentan-2-yl)-2-(propan-2-ylamino)acetamide
CID 156516034
methyl 2-[[2-[(2-aminoacetyl)amino]acetyl]amino]-2-methylpropanoate
CID 60851549
N-[3-(hydroxymethyl)pentan-3-yl]-2-(propan-2-ylamino)acetamide
CID 62520694
2-cyclopropyl-2-[[2-(propan-2-ylamino)acetyl]amino]propanoic acid
CID 61161568
methyl 2-[(4-amino-2-methylbutanoyl)amino]-2-methylpropanoate
CID 80543490
N-tert-butyl-2-[(1-methoxy-3-methylbutan-2-yl)amino]acetamide
CID 65048909
methyl 2-[[3-(ethylamino)-2-methylpropanoyl]amino]-2-methylpropanoate
CID 62851658
methyl 2-[[(2R)-2-amino-3-methylbutanoyl]amino]-2-methylpropanoate
CID 79011701
methyl 2-methyl-2-(3-methylbutan-2-ylamino)propanoate
CID 43726051
(2R)-3,3-dimethyl-2-[[2-(propan-2-ylamino)acetyl]amino]butanoic acid
CID 103927229
N-(4-methoxybutan-2-yl)-2-(propan-2-ylamino)acetamide
CID 64605255

Frequently Asked Questions

What is the IUPAC name of methyl 2-methyl-2-[[2-(propan-2-ylamino)acetyl]amino]propanoate?
The IUPAC name of methyl 2-methyl-2-[[2-(propan-2-ylamino)acetyl]amino]propanoate (CID 60841662) is methyl 2-methyl-2-[[2-(propan-2-ylamino)acetyl]amino]propanoate.
What is the SMILES notation for methyl 2-methyl-2-[[2-(propan-2-ylamino)acetyl]amino]propanoate?
The canonical SMILES for methyl 2-methyl-2-[[2-(propan-2-ylamino)acetyl]amino]propanoate is COC(=O)C(C)(C)NC(=O)CNC(C)C.
What is the InChIKey of methyl 2-methyl-2-[[2-(propan-2-ylamino)acetyl]amino]propanoate?
The InChIKey is LEYJRFJCYFRVED-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O3/c1-7(2)11-6-8(13)12-10(3,4)9(14)15-5/h7,11H,6H2,1-5H3,(H,12,13).
What are the key properties of methyl 2-methyl-2-[[2-(propan-2-ylamino)acetyl]amino]propanoate?
methyl 2-methyl-2-[[2-(propan-2-ylamino)acetyl]amino]propanoate has a molecular weight of 216.28 g/mol, XLogP of 0.05, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-methyl-2-[[2-(propan-2-ylamino)acetyl]amino]propanoate is sourced from PubChem (CID 60841662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).