2-(cyclobutylcarbamoylamino)-N-ethylacetamide

C9H17N3O2 — CID 115617813

IUPAC2-(cyclobutylcarbamoylamino)-N-ethylacetamide
SMILESCCNC(=O)CNC(=O)NC1CCC1
InChIInChI=1S/C9H17N3O2/c1-2-10-8(13)6-11-9(14)12-7-4-3-5-7/h7H,2-6H2,1H3,(H,10,13)(H2,11,12,14)
InChIKeyJPGFJFODGDAUFX-UHFFFAOYSA-N
MW199.25 g/mol
LogP-0.03
Rot. Bonds4

About 2-(cyclobutylcarbamoylamino)-N-ethylacetamide

2-(cyclobutylcarbamoylamino)-N-ethylacetamide (PubChem CID 115617813) has the molecular formula C9H17N3O2 and a molecular weight of 199.25 g/mol. Its IUPAC name is 2-(cyclobutylcarbamoylamino)-N-ethylacetamide.

Molecular Properties

Compound Name2-(cyclobutylcarbamoylamino)-N-ethylacetamide
PubChem CID115617813
Molecular FormulaC9H17N3O2
Molecular Weight199.25 g/mol
Exact Mass199.13
IUPAC Name2-(cyclobutylcarbamoylamino)-N-ethylacetamide
SMILESCCNC(=O)CNC(=O)NC1CCC1
InChIInChI=1S/C9H17N3O2/c1-2-10-8(13)6-11-9(14)12-7-4-3-5-7/h7H,2-6H2,1H3,(H,10,13)(H2,11,12,14)
InChIKeyJPGFJFODGDAUFX-UHFFFAOYSA-N
XLogP-0.03
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 5-0.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclopentyl-3-ethylurea;ethane
CID 145358709
N-cyclohexyl-2-(cyclopentylcarbamoylamino)acetamide
CID 84516190
2-(cyclopentylcarbamoylamino)-N-(2-methoxyethyl)acetamide
CID 38170461
2-(cyclohexylcarbamoylamino)-N-(2-methoxyethyl)acetamide
CID 47122602
2-(cyclododecylamino)-N-ethylacetamide
CID 43399943
2-(cyclooctylamino)-N-ethylacetamide
CID 28575760
1-ethyl-3-(3-hydroxycyclohexyl)urea
CID 103618902
2-(cyclohexylcarbamoylamino)-N-[2-(methylamino)propyl]acetamide;hydrochloride
CID 120829409
2-(cyclohexylcarbamoylamino)-N-(3-methoxypropyl)acetamide
CID 47318586
1-cyclopentyl-3-propylurea
CID 14343339
2-(cyclopentylcarbamoylamino)-N,N-dimethylacetamide
CID 38168189
3-(cyclobutylcarbamoylamino)-N-methylpropanamide
CID 115617988

Frequently Asked Questions

What is the IUPAC name of 2-(cyclobutylcarbamoylamino)-N-ethylacetamide?
The IUPAC name of 2-(cyclobutylcarbamoylamino)-N-ethylacetamide (CID 115617813) is 2-(cyclobutylcarbamoylamino)-N-ethylacetamide.
What is the SMILES notation for 2-(cyclobutylcarbamoylamino)-N-ethylacetamide?
The canonical SMILES for 2-(cyclobutylcarbamoylamino)-N-ethylacetamide is CCNC(=O)CNC(=O)NC1CCC1.
What is the InChIKey of 2-(cyclobutylcarbamoylamino)-N-ethylacetamide?
The InChIKey is JPGFJFODGDAUFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O2/c1-2-10-8(13)6-11-9(14)12-7-4-3-5-7/h7H,2-6H2,1H3,(H,10,13)(H2,11,12,14).
What are the key properties of 2-(cyclobutylcarbamoylamino)-N-ethylacetamide?
2-(cyclobutylcarbamoylamino)-N-ethylacetamide has a molecular weight of 199.25 g/mol, XLogP of -0.03, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclobutylcarbamoylamino)-N-ethylacetamide is sourced from PubChem (CID 115617813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).