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

C7H16N2O2 — CID 82937754

IUPAC2-[1-(dimethylamino)propan-2-ylamino]acetic acid
SMILESCC(CN(C)C)NCC(=O)O
InChIInChI=1S/C7H16N2O2/c1-6(5-9(2)3)8-4-7(10)11/h6,8H,4-5H2,1-3H3,(H,10,11)
InChIKeyUGFVOVZFLUFYNI-UHFFFAOYSA-N
MW160.22 g/mol
LogP-0.39
Rot. Bonds5

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

2-[1-(dimethylamino)propan-2-ylamino]acetic acid (PubChem CID 82937754) has the molecular formula C7H16N2O2 and a molecular weight of 160.22 g/mol. Its IUPAC name is 2-[1-(dimethylamino)propan-2-ylamino]acetic acid.

Molecular Properties

Compound Name2-[1-(dimethylamino)propan-2-ylamino]acetic acid
PubChem CID82937754
Molecular FormulaC7H16N2O2
Molecular Weight160.22 g/mol
Exact Mass160.12
IUPAC Name2-[1-(dimethylamino)propan-2-ylamino]acetic acid
SMILESCC(CN(C)C)NCC(=O)O
InChIInChI=1S/C7H16N2O2/c1-6(5-9(2)3)8-4-7(10)11/h6,8H,4-5H2,1-3H3,(H,10,11)
InChIKeyUGFVOVZFLUFYNI-UHFFFAOYSA-N
XLogP-0.39
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 5-0.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[1-(dimethylamino)-3-methylbutan-2-yl]amino]acetic acid
CID 61480028
ethyl 2-[1-(dimethylamino)propan-2-ylamino]acetate
CID 82938567
2-[1-(dimethylamino)propan-2-ylamino]-1-piperidin-1-ylethanone
CID 82938717
2-(carboxymethylamino)propanoic acid
CID 2764308
2-[1-(dimethylamino)propan-2-ylamino]-N-(2-methylbutan-2-yl)acetamide
CID 82938261
N-cyclopropyl-2-[1-(dimethylamino)propan-2-ylamino]-N-ethylacetamide
CID 82938894
(2R)-1-[1-(dimethylamino)propan-2-ylamino]propan-2-ol
CID 106932409
N-cyclohexyl-2-[1-(dimethylamino)propan-2-ylamino]acetamide
CID 82938571
2-N-ethyl-1-N,1-N-dimethylpropane-1,2-diamine
CID 23008779
4-[1-(dimethylamino)propan-2-ylcarbamoylamino]-4-oxobutanoic acid
CID 82937494
(3Z,5Z)-4-[[1-(dimethylamino)propan-2-ylamino]methyl]octa-3,5,7-trien-2-one
CID 166661154
N-[1-(dimethylamino)propan-2-yl]-2-methylpropanamide
CID 22973200

Frequently Asked Questions

What is the IUPAC name of 2-[1-(dimethylamino)propan-2-ylamino]acetic acid?
The IUPAC name of 2-[1-(dimethylamino)propan-2-ylamino]acetic acid (CID 82937754) is 2-[1-(dimethylamino)propan-2-ylamino]acetic acid.
What is the SMILES notation for 2-[1-(dimethylamino)propan-2-ylamino]acetic acid?
The canonical SMILES for 2-[1-(dimethylamino)propan-2-ylamino]acetic acid is CC(CN(C)C)NCC(=O)O.
What is the InChIKey of 2-[1-(dimethylamino)propan-2-ylamino]acetic acid?
The InChIKey is UGFVOVZFLUFYNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O2/c1-6(5-9(2)3)8-4-7(10)11/h6,8H,4-5H2,1-3H3,(H,10,11).
What are the key properties of 2-[1-(dimethylamino)propan-2-ylamino]acetic acid?
2-[1-(dimethylamino)propan-2-ylamino]acetic acid has a molecular weight of 160.22 g/mol, XLogP of -0.39, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(dimethylamino)propan-2-ylamino]acetic acid is sourced from PubChem (CID 82937754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).