N-tert-butyl-2-(methylamino)acetamide

C7H16N2O — CID 4962512

IUPACN-tert-butyl-2-(methylamino)acetamide
SMILESCNCC(=O)NC(C)(C)C
InChIInChI=1S/C7H16N2O/c1-7(2,3)9-6(10)5-8-4/h8H,5H2,1-4H3,(H,9,10)
InChIKeyPKKPXMPHLXGWQN-UHFFFAOYSA-N
MW144.22 g/mol
LogP0.12
Rot. Bonds2

About N-tert-butyl-2-(methylamino)acetamide

N-tert-butyl-2-(methylamino)acetamide (PubChem CID 4962512) has the molecular formula C7H16N2O and a molecular weight of 144.22 g/mol. Its IUPAC name is N-tert-butyl-2-(methylamino)acetamide.

Molecular Properties

Compound NameN-tert-butyl-2-(methylamino)acetamide
PubChem CID4962512
Molecular FormulaC7H16N2O
Molecular Weight144.22 g/mol
Exact Mass144.13
IUPAC NameN-tert-butyl-2-(methylamino)acetamide
SMILESCNCC(=O)NC(C)(C)C
InChIInChI=1S/C7H16N2O/c1-7(2,3)9-6(10)5-8-4/h8H,5H2,1-4H3,(H,9,10)
InChIKeyPKKPXMPHLXGWQN-UHFFFAOYSA-N
XLogP0.12
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.22
LogP ≤ 50.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-(methylamino)acetamide?
The IUPAC name of N-tert-butyl-2-(methylamino)acetamide (CID 4962512) is N-tert-butyl-2-(methylamino)acetamide.
What is the SMILES notation for N-tert-butyl-2-(methylamino)acetamide?
The canonical SMILES for N-tert-butyl-2-(methylamino)acetamide is CNCC(=O)NC(C)(C)C.
What is the InChIKey of N-tert-butyl-2-(methylamino)acetamide?
The InChIKey is PKKPXMPHLXGWQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O/c1-7(2,3)9-6(10)5-8-4/h8H,5H2,1-4H3,(H,9,10).
What are the key properties of N-tert-butyl-2-(methylamino)acetamide?
N-tert-butyl-2-(methylamino)acetamide has a molecular weight of 144.22 g/mol, XLogP of 0.12, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-(methylamino)acetamide is sourced from PubChem (CID 4962512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).