3-amino-N-(2-methoxyethyl)-N,3-dimethylbutanamide

C9H20N2O2 — CID 64676750

IUPAC3-amino-N-(2-methoxyethyl)-N,3-dimethylbutanamide
SMILESCOCCN(C)C(=O)CC(C)(C)N
InChIInChI=1S/C9H20N2O2/c1-9(2,10)7-8(12)11(3)5-6-13-4/h5-7,10H2,1-4H3
InChIKeyZFFSDHQSBQGQQX-UHFFFAOYSA-N
MW188.27 g/mol
LogP0.22
Rot. Bonds5

About 3-amino-N-(2-methoxyethyl)-N,3-dimethylbutanamide

3-amino-N-(2-methoxyethyl)-N,3-dimethylbutanamide (PubChem CID 64676750) has the molecular formula C9H20N2O2 and a molecular weight of 188.27 g/mol. Its IUPAC name is 3-amino-N-(2-methoxyethyl)-N,3-dimethylbutanamide.

Molecular Properties

Compound Name3-amino-N-(2-methoxyethyl)-N,3-dimethylbutanamide
PubChem CID64676750
Molecular FormulaC9H20N2O2
Molecular Weight188.27 g/mol
Exact Mass188.15
IUPAC Name3-amino-N-(2-methoxyethyl)-N,3-dimethylbutanamide
SMILESCOCCN(C)C(=O)CC(C)(C)N
InChIInChI=1S/C9H20N2O2/c1-9(2,10)7-8(12)11(3)5-6-13-4/h5-7,10H2,1-4H3
InChIKeyZFFSDHQSBQGQQX-UHFFFAOYSA-N
XLogP0.22
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-methoxyethyl)-N,3-dimethylbutanamide?
The IUPAC name of 3-amino-N-(2-methoxyethyl)-N,3-dimethylbutanamide (CID 64676750) is 3-amino-N-(2-methoxyethyl)-N,3-dimethylbutanamide.
What is the SMILES notation for 3-amino-N-(2-methoxyethyl)-N,3-dimethylbutanamide?
The canonical SMILES for 3-amino-N-(2-methoxyethyl)-N,3-dimethylbutanamide is COCCN(C)C(=O)CC(C)(C)N.
What is the InChIKey of 3-amino-N-(2-methoxyethyl)-N,3-dimethylbutanamide?
The InChIKey is ZFFSDHQSBQGQQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O2/c1-9(2,10)7-8(12)11(3)5-6-13-4/h5-7,10H2,1-4H3.
What are the key properties of 3-amino-N-(2-methoxyethyl)-N,3-dimethylbutanamide?
3-amino-N-(2-methoxyethyl)-N,3-dimethylbutanamide has a molecular weight of 188.27 g/mol, XLogP of 0.22, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-methoxyethyl)-N,3-dimethylbutanamide is sourced from PubChem (CID 64676750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).