2-methyl-N-propan-2-ylpropanamide;N,N,2-trimethylpropanamide

C13H28N2O2 — CID 139213516

IUPAC2-methyl-N-propan-2-ylpropanamide;N,N,2-trimethylpropanamide
SMILESCC(C)C(=O)N(C)C.CC(C)NC(=O)C(C)C
InChIInChI=1S/C7H15NO.C6H13NO/c1-5(2)7(9)8-6(3)4;1-5(2)6(8)7(3)4/h5-6H,1-4H3,(H,8,9);5H,1-4H3
InChIKeyFROQTQIIOUWMDC-UHFFFAOYSA-N
MW244.38 g/mol
LogP1.90
Rot. Bonds3

About 2-methyl-N-propan-2-ylpropanamide;N,N,2-trimethylpropanamide

2-methyl-N-propan-2-ylpropanamide;N,N,2-trimethylpropanamide (PubChem CID 139213516) has the molecular formula C13H28N2O2 and a molecular weight of 244.38 g/mol. Its IUPAC name is 2-methyl-N-propan-2-ylpropanamide;N,N,2-trimethylpropanamide.

Molecular Properties

Compound Name2-methyl-N-propan-2-ylpropanamide;N,N,2-trimethylpropanamide
PubChem CID139213516
Molecular FormulaC13H28N2O2
Molecular Weight244.38 g/mol
Exact Mass244.22
IUPAC Name2-methyl-N-propan-2-ylpropanamide;N,N,2-trimethylpropanamide
SMILESCC(C)C(=O)N(C)C.CC(C)NC(=O)C(C)C
InChIInChI=1S/C7H15NO.C6H13NO/c1-5(2)7(9)8-6(3)4;1-5(2)6(8)7(3)4/h5-6H,1-4H3,(H,8,9);5H,1-4H3
InChIKeyFROQTQIIOUWMDC-UHFFFAOYSA-N
XLogP1.90
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-propan-2-ylpropanamide;N,N,2-trimethylpropanamide?
The IUPAC name of 2-methyl-N-propan-2-ylpropanamide;N,N,2-trimethylpropanamide (CID 139213516) is 2-methyl-N-propan-2-ylpropanamide;N,N,2-trimethylpropanamide.
What is the SMILES notation for 2-methyl-N-propan-2-ylpropanamide;N,N,2-trimethylpropanamide?
The canonical SMILES for 2-methyl-N-propan-2-ylpropanamide;N,N,2-trimethylpropanamide is CC(C)C(=O)N(C)C.CC(C)NC(=O)C(C)C.
What is the InChIKey of 2-methyl-N-propan-2-ylpropanamide;N,N,2-trimethylpropanamide?
The InChIKey is FROQTQIIOUWMDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO.C6H13NO/c1-5(2)7(9)8-6(3)4;1-5(2)6(8)7(3)4/h5-6H,1-4H3,(H,8,9);5H,1-4H3.
What are the key properties of 2-methyl-N-propan-2-ylpropanamide;N,N,2-trimethylpropanamide?
2-methyl-N-propan-2-ylpropanamide;N,N,2-trimethylpropanamide has a molecular weight of 244.38 g/mol, XLogP of 1.90, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-propan-2-ylpropanamide;N,N,2-trimethylpropanamide is sourced from PubChem (CID 139213516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).