2-[[1-(dimethylamino)-1-oxopropan-2-yl]-propan-2-ylamino]acetic acid

C10H20N2O3 — CID 60838093

IUPAC2-[[1-(dimethylamino)-1-oxopropan-2-yl]-propan-2-ylamino]acetic acid
SMILESCC(C)N(CC(=O)O)C(C)C(=O)N(C)C
InChIInChI=1S/C10H20N2O3/c1-7(2)12(6-9(13)14)8(3)10(15)11(4)5/h7-8H,6H2,1-5H3,(H,13,14)
InChIKeyMTBXWWIDPWMRLE-UHFFFAOYSA-N
MW216.28 g/mol
LogP0.26
Rot. Bonds5

About 2-[[1-(dimethylamino)-1-oxopropan-2-yl]-propan-2-ylamino]acetic acid

2-[[1-(dimethylamino)-1-oxopropan-2-yl]-propan-2-ylamino]acetic acid (PubChem CID 60838093) has the molecular formula C10H20N2O3 and a molecular weight of 216.28 g/mol. Its IUPAC name is 2-[[1-(dimethylamino)-1-oxopropan-2-yl]-propan-2-ylamino]acetic acid.

Molecular Properties

Compound Name2-[[1-(dimethylamino)-1-oxopropan-2-yl]-propan-2-ylamino]acetic acid
PubChem CID60838093
Molecular FormulaC10H20N2O3
Molecular Weight216.28 g/mol
Exact Mass216.15
IUPAC Name2-[[1-(dimethylamino)-1-oxopropan-2-yl]-propan-2-ylamino]acetic acid
SMILESCC(C)N(CC(=O)O)C(C)C(=O)N(C)C
InChIInChI=1S/C10H20N2O3/c1-7(2)12(6-9(13)14)8(3)10(15)11(4)5/h7-8H,6H2,1-5H3,(H,13,14)
InChIKeyMTBXWWIDPWMRLE-UHFFFAOYSA-N
XLogP0.26
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 50.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[butan-2-yl(propan-2-yl)amino]acetic acid
CID 60839836
2-[2-(dimethylamino)ethyl-[1-(dimethylamino)-1-oxopropan-2-yl]amino]acetic acid
CID 107425598
2-[carboxymethyl(propan-2-yl)amino]-3-methylbutanoic acid
CID 87096245
2-[1-cyclopropylethyl(propan-2-yl)amino]acetic acid
CID 65057237
2-[3-oxobutan-2-yl(propan-2-yl)amino]acetamide
CID 62036844
2-[amino(propan-2-yl)amino]acetic acid
CID 10887948
2-[propan-2-yl-[1-(4-propan-2-ylphenyl)ethyl]amino]acetic acid
CID 65057052
(2S)-2-[1-carboxyethyl(carboxymethyl)amino]-3-hydroxypropanoic acid
CID 139761783
2-[(1-amino-1-oxopropan-2-yl)-butan-2-ylamino]acetic acid
CID 60833253
2-[[2-[di(propan-2-yl)amino]-2-oxoethyl]-methylamino]acetic acid
CID 43442430
2-[carboxymethyl-[methyl(propan-2-yl)sulfamoyl]amino]acetic acid
CID 55245356
[(2S)-1-(dimethylamino)-1-oxopropan-2-yl]-methoxycarbamic acid
CID 141070387

Frequently Asked Questions

What is the IUPAC name of 2-[[1-(dimethylamino)-1-oxopropan-2-yl]-propan-2-ylamino]acetic acid?
The IUPAC name of 2-[[1-(dimethylamino)-1-oxopropan-2-yl]-propan-2-ylamino]acetic acid (CID 60838093) is 2-[[1-(dimethylamino)-1-oxopropan-2-yl]-propan-2-ylamino]acetic acid.
What is the SMILES notation for 2-[[1-(dimethylamino)-1-oxopropan-2-yl]-propan-2-ylamino]acetic acid?
The canonical SMILES for 2-[[1-(dimethylamino)-1-oxopropan-2-yl]-propan-2-ylamino]acetic acid is CC(C)N(CC(=O)O)C(C)C(=O)N(C)C.
What is the InChIKey of 2-[[1-(dimethylamino)-1-oxopropan-2-yl]-propan-2-ylamino]acetic acid?
The InChIKey is MTBXWWIDPWMRLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O3/c1-7(2)12(6-9(13)14)8(3)10(15)11(4)5/h7-8H,6H2,1-5H3,(H,13,14).
What are the key properties of 2-[[1-(dimethylamino)-1-oxopropan-2-yl]-propan-2-ylamino]acetic acid?
2-[[1-(dimethylamino)-1-oxopropan-2-yl]-propan-2-ylamino]acetic acid has a molecular weight of 216.28 g/mol, XLogP of 0.26, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[1-(dimethylamino)-1-oxopropan-2-yl]-propan-2-ylamino]acetic acid is sourced from PubChem (CID 60838093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).