2-amino-3,3-dimethyl-N-(oxolan-2-ylmethyl)butanamide

C11H22N2O2 — CID 68920784

IUPAC2-amino-3,3-dimethyl-N-(oxolan-2-ylmethyl)butanamide
SMILESCC(C)(C)C(N)C(=O)NCC1CCCO1
InChIInChI=1S/C11H22N2O2/c1-11(2,3)9(12)10(14)13-7-8-5-4-6-15-8/h8-9H,4-7,12H2,1-3H3,(H,13,14)
InChIKeyUTBVMBYQZDEVFN-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.65
Rot. Bonds3

About 2-amino-3,3-dimethyl-N-(oxolan-2-ylmethyl)butanamide

2-amino-3,3-dimethyl-N-(oxolan-2-ylmethyl)butanamide (PubChem CID 68920784) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 2-amino-3,3-dimethyl-N-(oxolan-2-ylmethyl)butanamide.

Molecular Properties

Compound Name2-amino-3,3-dimethyl-N-(oxolan-2-ylmethyl)butanamide
PubChem CID68920784
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name2-amino-3,3-dimethyl-N-(oxolan-2-ylmethyl)butanamide
SMILESCC(C)(C)C(N)C(=O)NCC1CCCO1
InChIInChI=1S/C11H22N2O2/c1-11(2,3)9(12)10(14)13-7-8-5-4-6-15-8/h8-9H,4-7,12H2,1-3H3,(H,13,14)
InChIKeyUTBVMBYQZDEVFN-UHFFFAOYSA-N
XLogP0.65
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-3,3-dimethyl-N-(oxolan-2-ylmethyl)butanamide?
The IUPAC name of 2-amino-3,3-dimethyl-N-(oxolan-2-ylmethyl)butanamide (CID 68920784) is 2-amino-3,3-dimethyl-N-(oxolan-2-ylmethyl)butanamide.
What is the SMILES notation for 2-amino-3,3-dimethyl-N-(oxolan-2-ylmethyl)butanamide?
The canonical SMILES for 2-amino-3,3-dimethyl-N-(oxolan-2-ylmethyl)butanamide is CC(C)(C)C(N)C(=O)NCC1CCCO1.
What is the InChIKey of 2-amino-3,3-dimethyl-N-(oxolan-2-ylmethyl)butanamide?
The InChIKey is UTBVMBYQZDEVFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-11(2,3)9(12)10(14)13-7-8-5-4-6-15-8/h8-9H,4-7,12H2,1-3H3,(H,13,14).
What are the key properties of 2-amino-3,3-dimethyl-N-(oxolan-2-ylmethyl)butanamide?
2-amino-3,3-dimethyl-N-(oxolan-2-ylmethyl)butanamide has a molecular weight of 214.31 g/mol, XLogP of 0.65, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3,3-dimethyl-N-(oxolan-2-ylmethyl)butanamide is sourced from PubChem (CID 68920784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).