2-amino-2-cyclopropyl-N-methyl-N-(4-methylpentan-2-yl)propanamide

C13H26N2O — CID 60939188

IUPAC2-amino-2-cyclopropyl-N-methyl-N-(4-methylpentan-2-yl)propanamide
SMILESCC(C)CC(C)N(C)C(=O)C(C)(N)C1CC1
InChIInChI=1S/C13H26N2O/c1-9(2)8-10(3)15(5)12(16)13(4,14)11-6-7-11/h9-11H,6-8,14H2,1-5H3
InChIKeyOBOSXILGHYDXTK-UHFFFAOYSA-N
MW226.36 g/mol
LogP2.01
Rot. Bonds5

About 2-amino-2-cyclopropyl-N-methyl-N-(4-methylpentan-2-yl)propanamide

2-amino-2-cyclopropyl-N-methyl-N-(4-methylpentan-2-yl)propanamide (PubChem CID 60939188) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is 2-amino-2-cyclopropyl-N-methyl-N-(4-methylpentan-2-yl)propanamide.

Molecular Properties

Compound Name2-amino-2-cyclopropyl-N-methyl-N-(4-methylpentan-2-yl)propanamide
PubChem CID60939188
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name2-amino-2-cyclopropyl-N-methyl-N-(4-methylpentan-2-yl)propanamide
SMILESCC(C)CC(C)N(C)C(=O)C(C)(N)C1CC1
InChIInChI=1S/C13H26N2O/c1-9(2)8-10(3)15(5)12(16)13(4,14)11-6-7-11/h9-11H,6-8,14H2,1-5H3
InChIKeyOBOSXILGHYDXTK-UHFFFAOYSA-N
XLogP2.01
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-amino-2-cyclopropyl-N-methyl-N-(4-methylpentan-2-yl)propanamide?
The IUPAC name of 2-amino-2-cyclopropyl-N-methyl-N-(4-methylpentan-2-yl)propanamide (CID 60939188) is 2-amino-2-cyclopropyl-N-methyl-N-(4-methylpentan-2-yl)propanamide.
What is the SMILES notation for 2-amino-2-cyclopropyl-N-methyl-N-(4-methylpentan-2-yl)propanamide?
The canonical SMILES for 2-amino-2-cyclopropyl-N-methyl-N-(4-methylpentan-2-yl)propanamide is CC(C)CC(C)N(C)C(=O)C(C)(N)C1CC1.
What is the InChIKey of 2-amino-2-cyclopropyl-N-methyl-N-(4-methylpentan-2-yl)propanamide?
The InChIKey is OBOSXILGHYDXTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-9(2)8-10(3)15(5)12(16)13(4,14)11-6-7-11/h9-11H,6-8,14H2,1-5H3.
What are the key properties of 2-amino-2-cyclopropyl-N-methyl-N-(4-methylpentan-2-yl)propanamide?
2-amino-2-cyclopropyl-N-methyl-N-(4-methylpentan-2-yl)propanamide has a molecular weight of 226.36 g/mol, XLogP of 2.01, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-cyclopropyl-N-methyl-N-(4-methylpentan-2-yl)propanamide is sourced from PubChem (CID 60939188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).