2-[cyclopropylmethylcarbamoyl(2-methoxyethyl)amino]acetic acid

C10H18N2O4 — CID 79269872

IUPAC2-[cyclopropylmethylcarbamoyl(2-methoxyethyl)amino]acetic acid
SMILESCOCCN(CC(=O)O)C(=O)NCC1CC1
InChIInChI=1S/C10H18N2O4/c1-16-5-4-12(7-9(13)14)10(15)11-6-8-2-3-8/h8H,2-7H2,1H3,(H,11,15)(H,13,14)
InChIKeyGVERWRVKRAHKGR-UHFFFAOYSA-N
MW230.26 g/mol
LogP0.14
Rot. Bonds7

About 2-[cyclopropylmethylcarbamoyl(2-methoxyethyl)amino]acetic acid

2-[cyclopropylmethylcarbamoyl(2-methoxyethyl)amino]acetic acid (PubChem CID 79269872) has the molecular formula C10H18N2O4 and a molecular weight of 230.26 g/mol. Its IUPAC name is 2-[cyclopropylmethylcarbamoyl(2-methoxyethyl)amino]acetic acid.

Molecular Properties

Compound Name2-[cyclopropylmethylcarbamoyl(2-methoxyethyl)amino]acetic acid
PubChem CID79269872
Molecular FormulaC10H18N2O4
Molecular Weight230.26 g/mol
Exact Mass230.13
IUPAC Name2-[cyclopropylmethylcarbamoyl(2-methoxyethyl)amino]acetic acid
SMILESCOCCN(CC(=O)O)C(=O)NCC1CC1
InChIInChI=1S/C10H18N2O4/c1-16-5-4-12(7-9(13)14)10(15)11-6-8-2-3-8/h8H,2-7H2,1H3,(H,11,15)(H,13,14)
InChIKeyGVERWRVKRAHKGR-UHFFFAOYSA-N
XLogP0.14
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.26
LogP ≤ 50.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(4-ethylcyclohexyl)methylcarbamoyl-(2-methoxyethyl)amino]acetic acid
CID 79271258
2-[2-(dimethylcarbamoylamino)ethylcarbamoyl-(2-methoxyethyl)amino]acetic acid
CID 83113976
2-[cyclobutylcarbamoyl(2-methoxyethyl)amino]acetic acid
CID 79269687
2-[2-[cyclopentyl(methyl)amino]ethylcarbamoyl-(2-methoxyethyl)amino]acetic acid
CID 79271649
2-[carboxymethyl(cyclopentylmethylcarbamoyl)amino]acetic acid
CID 55246133
2-[2-acetamidoethylcarbamoyl(2-methoxyethyl)amino]acetic acid
CID 79269666
2-[cycloheptylcarbamoyl(2-methoxyethyl)amino]acetic acid
CID 79271342
2-[(3-methylcyclopentyl)methylcarbamoyl-propylamino]acetic acid
CID 107414624
2-[cyclopropylmethylcarbamoyl(methyl)amino]acetic acid
CID 43135716
2-[cyclopropylmethylcarbamoyl(2,2,2-trifluoroethyl)amino]acetic acid
CID 79258875
2-[(3,4-dimethylcyclohexyl)carbamoyl-(2-methoxyethyl)amino]acetic acid
CID 79272291
2-[(2,3-dimethylcyclohexyl)carbamoyl-(2-methoxyethyl)amino]acetic acid
CID 79272617

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopropylmethylcarbamoyl(2-methoxyethyl)amino]acetic acid?
The IUPAC name of 2-[cyclopropylmethylcarbamoyl(2-methoxyethyl)amino]acetic acid (CID 79269872) is 2-[cyclopropylmethylcarbamoyl(2-methoxyethyl)amino]acetic acid.
What is the SMILES notation for 2-[cyclopropylmethylcarbamoyl(2-methoxyethyl)amino]acetic acid?
The canonical SMILES for 2-[cyclopropylmethylcarbamoyl(2-methoxyethyl)amino]acetic acid is COCCN(CC(=O)O)C(=O)NCC1CC1.
What is the InChIKey of 2-[cyclopropylmethylcarbamoyl(2-methoxyethyl)amino]acetic acid?
The InChIKey is GVERWRVKRAHKGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O4/c1-16-5-4-12(7-9(13)14)10(15)11-6-8-2-3-8/h8H,2-7H2,1H3,(H,11,15)(H,13,14).
What are the key properties of 2-[cyclopropylmethylcarbamoyl(2-methoxyethyl)amino]acetic acid?
2-[cyclopropylmethylcarbamoyl(2-methoxyethyl)amino]acetic acid has a molecular weight of 230.26 g/mol, XLogP of 0.14, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopropylmethylcarbamoyl(2-methoxyethyl)amino]acetic acid is sourced from PubChem (CID 79269872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).