3-(dimethylamino)-N-ethyl-N,2-dimethylpropanamide

C9H20N2O — CID 20644277

IUPAC3-(dimethylamino)-N-ethyl-N,2-dimethylpropanamide
SMILESCCN(C)C(=O)C(C)CN(C)C
InChIInChI=1S/C9H20N2O/c1-6-11(5)9(12)8(2)7-10(3)4/h8H,6-7H2,1-5H3
InChIKeyLCAFIJQARGJJQJ-UHFFFAOYSA-N
MW172.27 g/mol
LogP0.66
Rot. Bonds4

About 3-(dimethylamino)-N-ethyl-N,2-dimethylpropanamide

3-(dimethylamino)-N-ethyl-N,2-dimethylpropanamide (PubChem CID 20644277) has the molecular formula C9H20N2O and a molecular weight of 172.27 g/mol. Its IUPAC name is 3-(dimethylamino)-N-ethyl-N,2-dimethylpropanamide.

Molecular Properties

Compound Name3-(dimethylamino)-N-ethyl-N,2-dimethylpropanamide
PubChem CID20644277
Molecular FormulaC9H20N2O
Molecular Weight172.27 g/mol
Exact Mass172.16
IUPAC Name3-(dimethylamino)-N-ethyl-N,2-dimethylpropanamide
SMILESCCN(C)C(=O)C(C)CN(C)C
InChIInChI=1S/C9H20N2O/c1-6-11(5)9(12)8(2)7-10(3)4/h8H,6-7H2,1-5H3
InChIKeyLCAFIJQARGJJQJ-UHFFFAOYSA-N
XLogP0.66
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 50.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)-N-ethyl-N,2-dimethylpropanamide?
The IUPAC name of 3-(dimethylamino)-N-ethyl-N,2-dimethylpropanamide (CID 20644277) is 3-(dimethylamino)-N-ethyl-N,2-dimethylpropanamide.
What is the SMILES notation for 3-(dimethylamino)-N-ethyl-N,2-dimethylpropanamide?
The canonical SMILES for 3-(dimethylamino)-N-ethyl-N,2-dimethylpropanamide is CCN(C)C(=O)C(C)CN(C)C.
What is the InChIKey of 3-(dimethylamino)-N-ethyl-N,2-dimethylpropanamide?
The InChIKey is LCAFIJQARGJJQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O/c1-6-11(5)9(12)8(2)7-10(3)4/h8H,6-7H2,1-5H3.
What are the key properties of 3-(dimethylamino)-N-ethyl-N,2-dimethylpropanamide?
3-(dimethylamino)-N-ethyl-N,2-dimethylpropanamide has a molecular weight of 172.27 g/mol, XLogP of 0.66, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)-N-ethyl-N,2-dimethylpropanamide is sourced from PubChem (CID 20644277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).