N-(3-amino-2,3-dimethylbutan-2-yl)propanamide

C9H20N2O — CID 156761451

IUPACN-(3-amino-2,3-dimethylbutan-2-yl)propanamide
SMILESCCC(=O)NC(C)(C)C(C)(C)N
InChIInChI=1S/C9H20N2O/c1-6-7(12)11-9(4,5)8(2,3)10/h6,10H2,1-5H3,(H,11,12)
InChIKeyRALJGNPQMVJLAU-UHFFFAOYSA-N
MW172.27 g/mol
LogP1.03
Rot. Bonds3

About N-(3-amino-2,3-dimethylbutan-2-yl)propanamide

N-(3-amino-2,3-dimethylbutan-2-yl)propanamide (PubChem CID 156761451) has the molecular formula C9H20N2O and a molecular weight of 172.27 g/mol. Its IUPAC name is N-(3-amino-2,3-dimethylbutan-2-yl)propanamide.

Molecular Properties

Compound NameN-(3-amino-2,3-dimethylbutan-2-yl)propanamide
PubChem CID156761451
Molecular FormulaC9H20N2O
Molecular Weight172.27 g/mol
Exact Mass172.16
IUPAC NameN-(3-amino-2,3-dimethylbutan-2-yl)propanamide
SMILESCCC(=O)NC(C)(C)C(C)(C)N
InChIInChI=1S/C9H20N2O/c1-6-7(12)11-9(4,5)8(2,3)10/h6,10H2,1-5H3,(H,11,12)
InChIKeyRALJGNPQMVJLAU-UHFFFAOYSA-N
XLogP1.03
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2,3-dimethylbutan-2-yl)propanamide?
The IUPAC name of N-(3-amino-2,3-dimethylbutan-2-yl)propanamide (CID 156761451) is N-(3-amino-2,3-dimethylbutan-2-yl)propanamide.
What is the SMILES notation for N-(3-amino-2,3-dimethylbutan-2-yl)propanamide?
The canonical SMILES for N-(3-amino-2,3-dimethylbutan-2-yl)propanamide is CCC(=O)NC(C)(C)C(C)(C)N.
What is the InChIKey of N-(3-amino-2,3-dimethylbutan-2-yl)propanamide?
The InChIKey is RALJGNPQMVJLAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O/c1-6-7(12)11-9(4,5)8(2,3)10/h6,10H2,1-5H3,(H,11,12).
What are the key properties of N-(3-amino-2,3-dimethylbutan-2-yl)propanamide?
N-(3-amino-2,3-dimethylbutan-2-yl)propanamide has a molecular weight of 172.27 g/mol, XLogP of 1.03, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2,3-dimethylbutan-2-yl)propanamide is sourced from PubChem (CID 156761451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).