2-[[2-(cyclopropylamino)-2-oxoethyl]amino]acetic acid

C7H12N2O3 — CID 43466149

IUPAC2-[[2-(cyclopropylamino)-2-oxoethyl]amino]acetic acid
SMILESO=C(O)CNCC(=O)NC1CC1
InChIInChI=1S/C7H12N2O3/c10-6(9-5-1-2-5)3-8-4-7(11)12/h5,8H,1-4H2,(H,9,10)(H,11,12)
InChIKeyGSHCAAXFSBPRFT-UHFFFAOYSA-N
MW172.18 g/mol
LogP-1.06
Rot. Bonds5

About 2-[[2-(cyclopropylamino)-2-oxoethyl]amino]acetic acid

2-[[2-(cyclopropylamino)-2-oxoethyl]amino]acetic acid (PubChem CID 43466149) has the molecular formula C7H12N2O3 and a molecular weight of 172.18 g/mol. Its IUPAC name is 2-[[2-(cyclopropylamino)-2-oxoethyl]amino]acetic acid.

Molecular Properties

Compound Name2-[[2-(cyclopropylamino)-2-oxoethyl]amino]acetic acid
PubChem CID43466149
Molecular FormulaC7H12N2O3
Molecular Weight172.18 g/mol
Exact Mass172.08
IUPAC Name2-[[2-(cyclopropylamino)-2-oxoethyl]amino]acetic acid
SMILESO=C(O)CNCC(=O)NC1CC1
InChIInChI=1S/C7H12N2O3/c10-6(9-5-1-2-5)3-8-4-7(11)12/h5,8H,1-4H2,(H,9,10)(H,11,12)
InChIKeyGSHCAAXFSBPRFT-UHFFFAOYSA-N
XLogP-1.06
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.18
LogP ≤ 5-1.06
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-[[2-(cyclopropylamino)-2-oxoethyl]amino]propanoic acid
CID 43466674
4-[[2-(cyclopropylamino)-2-oxoethyl]amino]butanoic acid
CID 43473310
N-cyclopropyl-2-(2,2-dimethylpropylamino)acetamide
CID 61167227
N-cyclopropyl-2-[(2-oxo-2-piperidin-1-ylethyl)amino]acetamide
CID 43401871
2-[[2-[(2-methylcyclohexyl)amino]-2-oxoethyl]amino]acetic acid
CID 43465971
2-(3-aminopropylamino)-N-cyclopropylacetamide
CID 62274184
N-(2-cyanoethyl)-2-[[2-(cyclopropylamino)-2-oxoethyl]amino]acetamide
CID 43401906
N-(4-methylcyclohexyl)-2-(propylamino)acetamide
CID 60671942
N-cyclopentyl-2-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]acetamide
CID 43402010
N,N'-dicyclopropylbutanediamide
CID 5225156
ethane;N-[4-(propanoylamino)cyclohexyl]propanamide
CID 144871719
N-cyclopropyl-2-(2-methylsulfonylethylamino)acetamide
CID 60915783

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(cyclopropylamino)-2-oxoethyl]amino]acetic acid?
The IUPAC name of 2-[[2-(cyclopropylamino)-2-oxoethyl]amino]acetic acid (CID 43466149) is 2-[[2-(cyclopropylamino)-2-oxoethyl]amino]acetic acid.
What is the SMILES notation for 2-[[2-(cyclopropylamino)-2-oxoethyl]amino]acetic acid?
The canonical SMILES for 2-[[2-(cyclopropylamino)-2-oxoethyl]amino]acetic acid is O=C(O)CNCC(=O)NC1CC1.
What is the InChIKey of 2-[[2-(cyclopropylamino)-2-oxoethyl]amino]acetic acid?
The InChIKey is GSHCAAXFSBPRFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O3/c10-6(9-5-1-2-5)3-8-4-7(11)12/h5,8H,1-4H2,(H,9,10)(H,11,12).
What are the key properties of 2-[[2-(cyclopropylamino)-2-oxoethyl]amino]acetic acid?
2-[[2-(cyclopropylamino)-2-oxoethyl]amino]acetic acid has a molecular weight of 172.18 g/mol, XLogP of -1.06, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(cyclopropylamino)-2-oxoethyl]amino]acetic acid is sourced from PubChem (CID 43466149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).