2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-propan-2-ylamino]acetic acid

C10H20N2O3 — CID 60839636

IUPAC2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-propan-2-ylamino]acetic acid
SMILESCCN(C)C(=O)CN(CC(=O)O)C(C)C
InChIInChI=1S/C10H20N2O3/c1-5-11(4)9(13)6-12(8(2)3)7-10(14)15/h8H,5-7H2,1-4H3,(H,14,15)
InChIKeyILDCWVVXJZUMTF-UHFFFAOYSA-N
MW216.28 g/mol
LogP0.26
Rot. Bonds6

About 2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-propan-2-ylamino]acetic acid

2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-propan-2-ylamino]acetic acid (PubChem CID 60839636) has the molecular formula C10H20N2O3 and a molecular weight of 216.28 g/mol. Its IUPAC name is 2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-propan-2-ylamino]acetic acid.

Molecular Properties

Compound Name2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-propan-2-ylamino]acetic acid
PubChem CID60839636
Molecular FormulaC10H20N2O3
Molecular Weight216.28 g/mol
Exact Mass216.15
IUPAC Name2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-propan-2-ylamino]acetic acid
SMILESCCN(C)C(=O)CN(CC(=O)O)C(C)C
InChIInChI=1S/C10H20N2O3/c1-5-11(4)9(13)6-12(8(2)3)7-10(14)15/h8H,5-7H2,1-4H3,(H,14,15)
InChIKeyILDCWVVXJZUMTF-UHFFFAOYSA-N
XLogP0.26
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
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-[[2-[ethyl(methyl)amino]-2-oxoethyl]-[1-[[2-[ethyl(methyl)amino]-2-oxoethyl]-(methylperoxymethyl)amino]ethyl]amino]acetic acid
CID 88908512
2-[[2-[cyclopropyl(methyl)amino]-2-oxoethyl]-propan-2-ylamino]acetic acid
CID 61488998
2-[[2-[benzyl(ethyl)amino]-2-oxoethyl]-propan-2-ylamino]acetic acid
CID 60839143
tris(N-ethyl-2-[formyl(methyl)amino]-N-methylacetamide);N-[2-[ethyl(methyl)amino]-2-oxoethyl]-N-methyl-2-[methyl(propan-2-yl)amino]acetamide;2-[formyl(methyl)amino]acetic acid
CID 176672156
2-[ethyl(propan-2-yl)amino]-N-methyl-N-propan-2-ylacetamide
CID 176579290
N-ethyl-4-[ethyl(propan-2-yl)amino]-N-methylbutanamide
CID 146482077
2-[butan-2-yl-[2-[di(propan-2-yl)amino]-2-oxoethyl]amino]acetic acid
CID 54925680
2-[[methyl(2,2,2-trifluoroethyl)carbamoyl]-propan-2-ylamino]acetic acid
CID 61204584
2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-prop-2-ynylamino]acetic acid
CID 79274369
N-ethyl-N,3-dimethylbutanamide
CID 18505916
3-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]butanoic acid
CID 61449220
3-[[[2-(diethylamino)-2-oxoethyl]-methylcarbamoyl]-propan-2-ylamino]propanoic acid
CID 61455997

Frequently Asked Questions

What is the IUPAC name of 2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-propan-2-ylamino]acetic acid?
The IUPAC name of 2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-propan-2-ylamino]acetic acid (CID 60839636) is 2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-propan-2-ylamino]acetic acid.
What is the SMILES notation for 2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-propan-2-ylamino]acetic acid?
The canonical SMILES for 2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-propan-2-ylamino]acetic acid is CCN(C)C(=O)CN(CC(=O)O)C(C)C.
What is the InChIKey of 2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-propan-2-ylamino]acetic acid?
The InChIKey is ILDCWVVXJZUMTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O3/c1-5-11(4)9(13)6-12(8(2)3)7-10(14)15/h8H,5-7H2,1-4H3,(H,14,15).
What are the key properties of 2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-propan-2-ylamino]acetic acid?
2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-propan-2-ylamino]acetic acid has a molecular weight of 216.28 g/mol, XLogP of 0.26, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-propan-2-ylamino]acetic acid is sourced from PubChem (CID 60839636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).