2-amino-N,3,3-trimethylbutanamide

C7H16N2O — CID 3496445

IUPAC2-amino-N,3,3-trimethylbutanamide
SMILESCNC(=O)C(N)C(C)(C)C
InChIInChI=1S/C7H16N2O/c1-7(2,3)5(8)6(10)9-4/h5H,8H2,1-4H3,(H,9,10)
InChIKeyBPKJNEIOHOEWLO-UHFFFAOYSA-N
MW144.22 g/mol
LogP0.11
Rot. Bonds1

About 2-amino-N,3,3-trimethylbutanamide

2-amino-N,3,3-trimethylbutanamide (PubChem CID 3496445) has the molecular formula C7H16N2O and a molecular weight of 144.22 g/mol. Its IUPAC name is 2-amino-N,3,3-trimethylbutanamide.

Molecular Properties

Compound Name2-amino-N,3,3-trimethylbutanamide
PubChem CID3496445
Molecular FormulaC7H16N2O
Molecular Weight144.22 g/mol
Exact Mass144.13
IUPAC Name2-amino-N,3,3-trimethylbutanamide
SMILESCNC(=O)C(N)C(C)(C)C
InChIInChI=1S/C7H16N2O/c1-7(2,3)5(8)6(10)9-4/h5H,8H2,1-4H3,(H,9,10)
InChIKeyBPKJNEIOHOEWLO-UHFFFAOYSA-N
XLogP0.11
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.22
LogP ≤ 50.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N,3,3-trimethylbutanamide?
The IUPAC name of 2-amino-N,3,3-trimethylbutanamide (CID 3496445) is 2-amino-N,3,3-trimethylbutanamide.
What is the SMILES notation for 2-amino-N,3,3-trimethylbutanamide?
The canonical SMILES for 2-amino-N,3,3-trimethylbutanamide is CNC(=O)C(N)C(C)(C)C.
What is the InChIKey of 2-amino-N,3,3-trimethylbutanamide?
The InChIKey is BPKJNEIOHOEWLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O/c1-7(2,3)5(8)6(10)9-4/h5H,8H2,1-4H3,(H,9,10).
What are the key properties of 2-amino-N,3,3-trimethylbutanamide?
2-amino-N,3,3-trimethylbutanamide has a molecular weight of 144.22 g/mol, XLogP of 0.11, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N,3,3-trimethylbutanamide is sourced from PubChem (CID 3496445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).