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

C10H20N2O3 — CID 43442688

IUPAC2-[methyl-[2-(2-methylbutan-2-ylamino)-2-oxoethyl]amino]acetic acid
SMILESCCC(C)(C)NC(=O)CN(C)CC(=O)O
InChIInChI=1S/C10H20N2O3/c1-5-10(2,3)11-8(13)6-12(4)7-9(14)15/h5-7H2,1-4H3,(H,11,13)(H,14,15)
InChIKeyVGDYUVQTRFJZEY-UHFFFAOYSA-N
MW216.28 g/mol
LogP0.31
Rot. Bonds6

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

2-[methyl-[2-(2-methylbutan-2-ylamino)-2-oxoethyl]amino]acetic acid (PubChem CID 43442688) has the molecular formula C10H20N2O3 and a molecular weight of 216.28 g/mol. Its IUPAC name is 2-[methyl-[2-(2-methylbutan-2-ylamino)-2-oxoethyl]amino]acetic acid.

Molecular Properties

Compound Name2-[methyl-[2-(2-methylbutan-2-ylamino)-2-oxoethyl]amino]acetic acid
PubChem CID43442688
Molecular FormulaC10H20N2O3
Molecular Weight216.28 g/mol
Exact Mass216.15
IUPAC Name2-[methyl-[2-(2-methylbutan-2-ylamino)-2-oxoethyl]amino]acetic acid
SMILESCCC(C)(C)NC(=O)CN(C)CC(=O)O
InChIInChI=1S/C10H20N2O3/c1-5-10(2,3)11-8(13)6-12(4)7-9(14)15/h5-7H2,1-4H3,(H,11,13)(H,14,15)
InChIKeyVGDYUVQTRFJZEY-UHFFFAOYSA-N
XLogP0.31
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 50.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-3-[methyl-[2-(2-methylbutan-2-ylamino)-2-oxoethyl]amino]propanoic acid
CID 55007733
3-(2-methylbutan-2-ylamino)-3-oxopropanoic acid
CID 62230049
2-(N-[2-(2-methylbutan-2-ylamino)-2-oxoethyl]anilino)acetic acid
CID 60839780
N-(4-chlorophenyl)-2-[methyl-[2-(2-methylbutan-2-ylamino)-2-oxoethyl]amino]acetamide
CID 8816582
2-[methyl-[2-(2-methylbutan-2-ylamino)-2-oxoethyl]amino]-N-(2,4,6-trimethylphenyl)acetamide
CID 8635344
2-(2,2-dimethylhydrazinyl)-N-(2-methylbutan-2-yl)acetamide
CID 83015090
2-hydroxy-N-(2-methylbutan-2-yl)acetamide
CID 43558880
N-(2-methylbutan-2-yl)-3-[methyl-[3-(2-methylbutan-2-ylamino)but-3-enyl]amino]propanamide
CID 126701035
2-[(3-hydroxypyrrolidin-3-yl)methyl-methylamino]-N-(2-methylbutan-2-yl)acetamide
CID 114761399
N-(2-methylbutan-2-yl)-2-[methyl(oxan-2-ylmethyl)amino]acetamide
CID 86825153
N-(2-methylbutan-2-yl)-2-[methyl(piperidin-3-ylmethyl)amino]acetamide
CID 106636496
2,2-dimethyl-4-(2-methylbutan-2-ylamino)-4-oxobutanoic acid
CID 65297658

Frequently Asked Questions

What is the IUPAC name of 2-[methyl-[2-(2-methylbutan-2-ylamino)-2-oxoethyl]amino]acetic acid?
The IUPAC name of 2-[methyl-[2-(2-methylbutan-2-ylamino)-2-oxoethyl]amino]acetic acid (CID 43442688) is 2-[methyl-[2-(2-methylbutan-2-ylamino)-2-oxoethyl]amino]acetic acid.
What is the SMILES notation for 2-[methyl-[2-(2-methylbutan-2-ylamino)-2-oxoethyl]amino]acetic acid?
The canonical SMILES for 2-[methyl-[2-(2-methylbutan-2-ylamino)-2-oxoethyl]amino]acetic acid is CCC(C)(C)NC(=O)CN(C)CC(=O)O.
What is the InChIKey of 2-[methyl-[2-(2-methylbutan-2-ylamino)-2-oxoethyl]amino]acetic acid?
The InChIKey is VGDYUVQTRFJZEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O3/c1-5-10(2,3)11-8(13)6-12(4)7-9(14)15/h5-7H2,1-4H3,(H,11,13)(H,14,15).
What are the key properties of 2-[methyl-[2-(2-methylbutan-2-ylamino)-2-oxoethyl]amino]acetic acid?
2-[methyl-[2-(2-methylbutan-2-ylamino)-2-oxoethyl]amino]acetic acid has a molecular weight of 216.28 g/mol, XLogP of 0.31, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-[2-(2-methylbutan-2-ylamino)-2-oxoethyl]amino]acetic acid is sourced from PubChem (CID 43442688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).