2-amino-N-carbamoyl-2-methylbutanamide

C6H13N3O2 — CID 79812267

IUPAC2-amino-N-carbamoyl-2-methylbutanamide
SMILESCCC(C)(N)C(=O)NC(N)=O
InChIInChI=1S/C6H13N3O2/c1-3-6(2,8)4(10)9-5(7)11/h3,8H2,1-2H3,(H3,7,9,10,11)
InChIKeySSBUKGOYPRJPCT-UHFFFAOYSA-N
MW159.19 g/mol
LogP-0.69
Rot. Bonds2

About 2-amino-N-carbamoyl-2-methylbutanamide

2-amino-N-carbamoyl-2-methylbutanamide (PubChem CID 79812267) has the molecular formula C6H13N3O2 and a molecular weight of 159.19 g/mol. Its IUPAC name is 2-amino-N-carbamoyl-2-methylbutanamide.

Molecular Properties

Compound Name2-amino-N-carbamoyl-2-methylbutanamide
PubChem CID79812267
Molecular FormulaC6H13N3O2
Molecular Weight159.19 g/mol
Exact Mass159.10
IUPAC Name2-amino-N-carbamoyl-2-methylbutanamide
SMILESCCC(C)(N)C(=O)NC(N)=O
InChIInChI=1S/C6H13N3O2/c1-3-6(2,8)4(10)9-5(7)11/h3,8H2,1-2H3,(H3,7,9,10,11)
InChIKeySSBUKGOYPRJPCT-UHFFFAOYSA-N
XLogP-0.69
TPSA98.21 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.19
LogP ≤ 5-0.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 2-amino-N-carbamoyl-2-methylbutanamide 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

N-carbamoyl-2-ethyl-2-methoxybutanamide
CID 23273727
2-[(2-amino-2-methylbutanoyl)amino]ethyl carbamate
CID 83211882
2-(15N)azanyl-2-methylbutanamide
CID 10844374
2-bromo-N-carbamoyl-2-ethylbutanamide;ethane
CID 87656093
azane;2-bromo-N-carbamoyl-2-ethylbutanamide
CID 173440732
2-amino-N-(2,2-dimethylpropyl)-2-methylbutanamide
CID 79805965
methyl (2S)-2-[(2-amino-2-methylbutanoyl)amino]propanoate
CID 79797109
2-amino-N-(2-hydroxy-2-methylbutyl)-2-methylbutanamide
CID 79811592
2-amino-N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]-2-methylbutanamide
CID 107865579
(2S)-2-amino-2-methylbutanoic acid
CID 6971276
2-amino-2-methyl-N-(2,2,3,3-tetramethylcyclopropyl)butanamide
CID 79810715
2-[(2-amino-2-methylbutanoyl)amino]-2-cyclohexylacetic acid
CID 79805005

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-carbamoyl-2-methylbutanamide?
The IUPAC name of 2-amino-N-carbamoyl-2-methylbutanamide (CID 79812267) is 2-amino-N-carbamoyl-2-methylbutanamide.
What is the SMILES notation for 2-amino-N-carbamoyl-2-methylbutanamide?
The canonical SMILES for 2-amino-N-carbamoyl-2-methylbutanamide is CCC(C)(N)C(=O)NC(N)=O.
What is the InChIKey of 2-amino-N-carbamoyl-2-methylbutanamide?
The InChIKey is SSBUKGOYPRJPCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N3O2/c1-3-6(2,8)4(10)9-5(7)11/h3,8H2,1-2H3,(H3,7,9,10,11).
What are the key properties of 2-amino-N-carbamoyl-2-methylbutanamide?
2-amino-N-carbamoyl-2-methylbutanamide has a molecular weight of 159.19 g/mol, XLogP of -0.69, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-carbamoyl-2-methylbutanamide is sourced from PubChem (CID 79812267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).