3-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-2,2,3-trimethylbutanamide

C12H25N3O2 — CID 114167258

IUPAC3-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-2,2,3-trimethylbutanamide
SMILESCC(C)(CNC(=O)C(C)(C)C(C)(C)N)C(N)=O
InChIInChI=1S/C12H25N3O2/c1-10(2,8(13)16)7-15-9(17)11(3,4)12(5,6)14/h7,14H2,1-6H3,(H2,13,16)(H,15,17)
InChIKeyDIINHPLEXVPHJD-UHFFFAOYSA-N
MW243.35 g/mol
LogP0.38
Rot. Bonds5

About 3-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-2,2,3-trimethylbutanamide

3-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-2,2,3-trimethylbutanamide (PubChem CID 114167258) has the molecular formula C12H25N3O2 and a molecular weight of 243.35 g/mol. Its IUPAC name is 3-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-2,2,3-trimethylbutanamide.

Molecular Properties

Compound Name3-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-2,2,3-trimethylbutanamide
PubChem CID114167258
Molecular FormulaC12H25N3O2
Molecular Weight243.35 g/mol
Exact Mass243.19
IUPAC Name3-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-2,2,3-trimethylbutanamide
SMILESCC(C)(CNC(=O)C(C)(C)C(C)(C)N)C(N)=O
InChIInChI=1S/C12H25N3O2/c1-10(2,8(13)16)7-15-9(17)11(3,4)12(5,6)14/h7,14H2,1-6H3,(H2,13,16)(H,15,17)
InChIKeyDIINHPLEXVPHJD-UHFFFAOYSA-N
XLogP0.38
TPSA98.21 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 50.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 3-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-2,2,3-trimethylbutanamide 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

3-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-2,2-dimethylpropanamide
CID 103809518
3-amino-N-(2,2-dimethylbutyl)-2,2,3-trimethylbutanamide
CID 103461615
3-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-2,2-dimethyl-3-sulfanylidenepropanamide
CID 106277356
3-amino-N-(2-aminoethyl)-2,2,3-trimethylbutanamide
CID 65270025
2-[(3-amino-2,2-dimethyl-3-oxopropyl)amino]-2-oxoacetic acid
CID 104767621
(2S)-2-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-3,3-dimethylbutanamide;hydrochloride
CID 119736012
3-hydrazinyl-2,2-dimethylpropanamide
CID 134242033
N-(3-amino-2,2-dimethyl-3-oxopropyl)-2-ethyl-2-(N'-hydroxycarbamimidoyl)butanamide
CID 106279632
3-amino-N-(1-amino-2-methyl-1-oxopropan-2-yl)-2,2,3-trimethylbutanamide
CID 65269732
N-(3-amino-2,2-dimethyl-3-oxopropyl)hexanamide
CID 141198616
(2S)-2-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-3-methylbutanamide;hydrochloride
CID 119296292
3-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-4,4-dimethylpentanamide
CID 114167246

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-2,2,3-trimethylbutanamide?
The IUPAC name of 3-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-2,2,3-trimethylbutanamide (CID 114167258) is 3-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-2,2,3-trimethylbutanamide.
What is the SMILES notation for 3-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-2,2,3-trimethylbutanamide?
The canonical SMILES for 3-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-2,2,3-trimethylbutanamide is CC(C)(CNC(=O)C(C)(C)C(C)(C)N)C(N)=O.
What is the InChIKey of 3-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-2,2,3-trimethylbutanamide?
The InChIKey is DIINHPLEXVPHJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O2/c1-10(2,8(13)16)7-15-9(17)11(3,4)12(5,6)14/h7,14H2,1-6H3,(H2,13,16)(H,15,17).
What are the key properties of 3-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-2,2,3-trimethylbutanamide?
3-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-2,2,3-trimethylbutanamide has a molecular weight of 243.35 g/mol, XLogP of 0.38, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-2,2,3-trimethylbutanamide is sourced from PubChem (CID 114167258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).