2-(1-aminocyclobutyl)-N-[2-(dimethylcarbamoylamino)ethyl]acetamide

C11H22N4O2 — CID 83112019

IUPAC2-(1-aminocyclobutyl)-N-[2-(dimethylcarbamoylamino)ethyl]acetamide
SMILESCN(C)C(=O)NCCNC(=O)CC1(N)CCC1
InChIInChI=1S/C11H22N4O2/c1-15(2)10(17)14-7-6-13-9(16)8-11(12)4-3-5-11/h3-8,12H2,1-2H3,(H,13,16)(H,14,17)
InChIKeyVQHFEZSJZIBTJX-UHFFFAOYSA-N
MW242.32 g/mol
LogP-0.35
Rot. Bonds5

About 2-(1-aminocyclobutyl)-N-[2-(dimethylcarbamoylamino)ethyl]acetamide

2-(1-aminocyclobutyl)-N-[2-(dimethylcarbamoylamino)ethyl]acetamide (PubChem CID 83112019) has the molecular formula C11H22N4O2 and a molecular weight of 242.32 g/mol. Its IUPAC name is 2-(1-aminocyclobutyl)-N-[2-(dimethylcarbamoylamino)ethyl]acetamide.

Molecular Properties

Compound Name2-(1-aminocyclobutyl)-N-[2-(dimethylcarbamoylamino)ethyl]acetamide
PubChem CID83112019
Molecular FormulaC11H22N4O2
Molecular Weight242.32 g/mol
Exact Mass242.17
IUPAC Name2-(1-aminocyclobutyl)-N-[2-(dimethylcarbamoylamino)ethyl]acetamide
SMILESCN(C)C(=O)NCCNC(=O)CC1(N)CCC1
InChIInChI=1S/C11H22N4O2/c1-15(2)10(17)14-7-6-13-9(16)8-11(12)4-3-5-11/h3-8,12H2,1-2H3,(H,13,16)(H,14,17)
InChIKeyVQHFEZSJZIBTJX-UHFFFAOYSA-N
XLogP-0.35
TPSA87.46 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 5-0.35
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

3-[[2-(1-aminocyclopentyl)acetyl]amino]-N,N-dimethylpropanamide
CID 64684460
2-(1-aminocyclobutyl)-N-(2-aminoethyl)acetamide
CID 79853853
2-(1-aminocyclobutyl)-N-[2-(methanesulfonamido)ethyl]acetamide
CID 79851894
2-(1-aminocyclobutyl)-N-[2-[cyclopropyl(methyl)amino]ethyl]acetamide
CID 79854308
2-(1-aminocyclobutyl)-N-[2-(dimethylamino)-2-methylpropyl]acetamide
CID 79854548
2-(1-aminocyclopentyl)-N-[2-(dimethylamino)-2-oxoethyl]acetamide
CID 64686359
3-[[2-(1-aminocyclobutyl)acetyl]amino]-N-propylpropanamide
CID 79853865
2-(1-aminocyclopentyl)-N-pentylacetamide
CID 64684132
2-(1-aminocyclopentyl)-N-(2-methylsulfanylethyl)acetamide
CID 64679274
2-(1-aminocyclobutyl)-N-[2-(2-methoxyethoxy)ethyl]acetamide
CID 79854561
2-(1-aminocyclobutyl)-N-(7-methyloctyl)acetamide
CID 79854287
2-(1-aminocyclobutyl)-N-(3-methylsulfanylbutyl)acetamide
CID 115739037

Frequently Asked Questions

What is the IUPAC name of 2-(1-aminocyclobutyl)-N-[2-(dimethylcarbamoylamino)ethyl]acetamide?
The IUPAC name of 2-(1-aminocyclobutyl)-N-[2-(dimethylcarbamoylamino)ethyl]acetamide (CID 83112019) is 2-(1-aminocyclobutyl)-N-[2-(dimethylcarbamoylamino)ethyl]acetamide.
What is the SMILES notation for 2-(1-aminocyclobutyl)-N-[2-(dimethylcarbamoylamino)ethyl]acetamide?
The canonical SMILES for 2-(1-aminocyclobutyl)-N-[2-(dimethylcarbamoylamino)ethyl]acetamide is CN(C)C(=O)NCCNC(=O)CC1(N)CCC1.
What is the InChIKey of 2-(1-aminocyclobutyl)-N-[2-(dimethylcarbamoylamino)ethyl]acetamide?
The InChIKey is VQHFEZSJZIBTJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N4O2/c1-15(2)10(17)14-7-6-13-9(16)8-11(12)4-3-5-11/h3-8,12H2,1-2H3,(H,13,16)(H,14,17).
What are the key properties of 2-(1-aminocyclobutyl)-N-[2-(dimethylcarbamoylamino)ethyl]acetamide?
2-(1-aminocyclobutyl)-N-[2-(dimethylcarbamoylamino)ethyl]acetamide has a molecular weight of 242.32 g/mol, XLogP of -0.35, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminocyclobutyl)-N-[2-(dimethylcarbamoylamino)ethyl]acetamide is sourced from PubChem (CID 83112019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).