2-amino-N-[2-(dimethylcarbamoylamino)ethyl]-3,3-dimethylbutanamide

C11H24N4O2 — CID 112555904

IUPAC2-amino-N-[2-(dimethylcarbamoylamino)ethyl]-3,3-dimethylbutanamide
SMILESCN(C)C(=O)NCCNC(=O)C(N)C(C)(C)C
InChIInChI=1S/C11H24N4O2/c1-11(2,3)8(12)9(16)13-6-7-14-10(17)15(4)5/h8H,6-7,12H2,1-5H3,(H,13,16)(H,14,17)
InChIKeyRKCDUGFSZIXNDK-UHFFFAOYSA-N
MW244.34 g/mol
LogP-0.25
Rot. Bonds4

About 2-amino-N-[2-(dimethylcarbamoylamino)ethyl]-3,3-dimethylbutanamide

2-amino-N-[2-(dimethylcarbamoylamino)ethyl]-3,3-dimethylbutanamide (PubChem CID 112555904) has the molecular formula C11H24N4O2 and a molecular weight of 244.34 g/mol. Its IUPAC name is 2-amino-N-[2-(dimethylcarbamoylamino)ethyl]-3,3-dimethylbutanamide.

Molecular Properties

Compound Name2-amino-N-[2-(dimethylcarbamoylamino)ethyl]-3,3-dimethylbutanamide
PubChem CID112555904
Molecular FormulaC11H24N4O2
Molecular Weight244.34 g/mol
Exact Mass244.19
IUPAC Name2-amino-N-[2-(dimethylcarbamoylamino)ethyl]-3,3-dimethylbutanamide
SMILESCN(C)C(=O)NCCNC(=O)C(N)C(C)(C)C
InChIInChI=1S/C11H24N4O2/c1-11(2,3)8(12)9(16)13-6-7-14-10(17)15(4)5/h8H,6-7,12H2,1-5H3,(H,13,16)(H,14,17)
InChIKeyRKCDUGFSZIXNDK-UHFFFAOYSA-N
XLogP-0.25
TPSA87.46 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 5-0.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-amino-N-[2-(dimethylcarbamoylamino)ethyl]-3,3-dimethylbutanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-2-amino-N-[2-(dimethylcarbamoylamino)ethyl]-3-methylbutanamide
CID 83110298
N-(2-acetamidoethyl)-2-amino-3,3-dimethylbutanamide
CID 76893602
(2S)-2-amino-N-(3,3-dimethylbutyl)-3,3-dimethylbutanamide
CID 103808439
(2S)-2-amino-3,3-dimethyl-N-[3-[methyl(propan-2-yl)amino]propyl]butanamide
CID 114140545
(2R)-2-amino-N-[2-(dimethylcarbamoylamino)ethyl]butanamide
CID 83110467
(2R)-2-amino-3,3-dimethyl-N-[2-[methyl(propan-2-yl)amino]ethyl]butanamide
CID 103929839
N-[2-(dimethylcarbamoylamino)ethyl]-2-methylpropanamide
CID 108575110
(2S)-2-amino-N-[2-(dimethylsulfamoyl)ethyl]-3,3-dimethylbutanamide
CID 114175289
2-amino-N-[2-(dimethylcarbamoylamino)ethyl]-2-methylpropanamide
CID 83111827
(2S)-2-amino-N-[2-(dimethylamino)-2-methylpropyl]-3,3-dimethylbutanamide;dihydrochloride
CID 119830610
(2R)-2-amino-N-(4-aminobutyl)-3,3-dimethylbutanamide
CID 103929631
2-amino-3,3-dimethyl-N-(3,3,3-trifluoropropyl)butanamide
CID 76988357

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(dimethylcarbamoylamino)ethyl]-3,3-dimethylbutanamide?
The IUPAC name of 2-amino-N-[2-(dimethylcarbamoylamino)ethyl]-3,3-dimethylbutanamide (CID 112555904) is 2-amino-N-[2-(dimethylcarbamoylamino)ethyl]-3,3-dimethylbutanamide.
What is the SMILES notation for 2-amino-N-[2-(dimethylcarbamoylamino)ethyl]-3,3-dimethylbutanamide?
The canonical SMILES for 2-amino-N-[2-(dimethylcarbamoylamino)ethyl]-3,3-dimethylbutanamide is CN(C)C(=O)NCCNC(=O)C(N)C(C)(C)C.
What is the InChIKey of 2-amino-N-[2-(dimethylcarbamoylamino)ethyl]-3,3-dimethylbutanamide?
The InChIKey is RKCDUGFSZIXNDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N4O2/c1-11(2,3)8(12)9(16)13-6-7-14-10(17)15(4)5/h8H,6-7,12H2,1-5H3,(H,13,16)(H,14,17).
What are the key properties of 2-amino-N-[2-(dimethylcarbamoylamino)ethyl]-3,3-dimethylbutanamide?
2-amino-N-[2-(dimethylcarbamoylamino)ethyl]-3,3-dimethylbutanamide has a molecular weight of 244.34 g/mol, XLogP of -0.25, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(dimethylcarbamoylamino)ethyl]-3,3-dimethylbutanamide is sourced from PubChem (CID 112555904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).