2-(cyclopropylcarbamoylamino)-N-(2-methoxyethyl)acetamide

C9H17N3O3 — CID 47127449

IUPAC2-(cyclopropylcarbamoylamino)-N-(2-methoxyethyl)acetamide
SMILESCOCCNC(=O)CNC(=O)NC1CC1
InChIInChI=1S/C9H17N3O3/c1-15-5-4-10-8(13)6-11-9(14)12-7-2-3-7/h7H,2-6H2,1H3,(H,10,13)(H2,11,12,14)
InChIKeyUTUKBKJGQKZOTK-UHFFFAOYSA-N
MW215.25 g/mol
LogP-0.79
Rot. Bonds6

About 2-(cyclopropylcarbamoylamino)-N-(2-methoxyethyl)acetamide

2-(cyclopropylcarbamoylamino)-N-(2-methoxyethyl)acetamide (PubChem CID 47127449) has the molecular formula C9H17N3O3 and a molecular weight of 215.25 g/mol. Its IUPAC name is 2-(cyclopropylcarbamoylamino)-N-(2-methoxyethyl)acetamide.

Molecular Properties

Compound Name2-(cyclopropylcarbamoylamino)-N-(2-methoxyethyl)acetamide
PubChem CID47127449
Molecular FormulaC9H17N3O3
Molecular Weight215.25 g/mol
Exact Mass215.13
IUPAC Name2-(cyclopropylcarbamoylamino)-N-(2-methoxyethyl)acetamide
SMILESCOCCNC(=O)CNC(=O)NC1CC1
InChIInChI=1S/C9H17N3O3/c1-15-5-4-10-8(13)6-11-9(14)12-7-2-3-7/h7H,2-6H2,1H3,(H,10,13)(H2,11,12,14)
InChIKeyUTUKBKJGQKZOTK-UHFFFAOYSA-N
XLogP-0.79
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 5-0.79
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(cyclopentylcarbamoylamino)-N-(2-methoxyethyl)acetamide
CID 38170461
2-(cyclohexylcarbamoylamino)-N-(2-methoxyethyl)acetamide
CID 47122602
2-(cyclohexylcarbamoylamino)-N-(3-methoxypropyl)acetamide
CID 47318586
N-(2-methoxyethyl)-2-[[N'-methyl-N-(4-methylcyclohexyl)carbamimidoyl]amino]acetamide;hydroiodide
CID 111255614
N-(2-methoxyethyl)-2-[(4-propan-2-ylcyclohexyl)amino]acetamide
CID 113242883
1-(4-amino-4-methylcyclohexyl)-3-(2-methoxyethyl)urea
CID 165468943
N'-cyclopropyl-N-(3-methoxypropyl)propanediamide
CID 108940973
2-(butylcarbamoylamino)-N-(2-methoxyethyl)acetamide
CID 115574241
cis-(1R,3S)-3-[2-(2-methoxyethoxy)ethylcarbamoylamino]cyclopentane-1-carboxylic acid
CID 106319589
2-(cyclobutylcarbamoylamino)-N-ethylacetamide
CID 115617813
2-(cyclopropylcarbamoylamino)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
CID 112994029
1-cyclobutyl-3-(4-methoxybutyl)urea
CID 84519072

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylcarbamoylamino)-N-(2-methoxyethyl)acetamide?
The IUPAC name of 2-(cyclopropylcarbamoylamino)-N-(2-methoxyethyl)acetamide (CID 47127449) is 2-(cyclopropylcarbamoylamino)-N-(2-methoxyethyl)acetamide.
What is the SMILES notation for 2-(cyclopropylcarbamoylamino)-N-(2-methoxyethyl)acetamide?
The canonical SMILES for 2-(cyclopropylcarbamoylamino)-N-(2-methoxyethyl)acetamide is COCCNC(=O)CNC(=O)NC1CC1.
What is the InChIKey of 2-(cyclopropylcarbamoylamino)-N-(2-methoxyethyl)acetamide?
The InChIKey is UTUKBKJGQKZOTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O3/c1-15-5-4-10-8(13)6-11-9(14)12-7-2-3-7/h7H,2-6H2,1H3,(H,10,13)(H2,11,12,14).
What are the key properties of 2-(cyclopropylcarbamoylamino)-N-(2-methoxyethyl)acetamide?
2-(cyclopropylcarbamoylamino)-N-(2-methoxyethyl)acetamide has a molecular weight of 215.25 g/mol, XLogP of -0.79, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylcarbamoylamino)-N-(2-methoxyethyl)acetamide is sourced from PubChem (CID 47127449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).