2-amino-N-ethyl-N,3-dimethylpentanamide

C9H20N2O — CID 23595882

IUPAC2-amino-N-ethyl-N,3-dimethylpentanamide
SMILESCCC(C)C(N)C(=O)N(C)CC
InChIInChI=1S/C9H20N2O/c1-5-7(3)8(10)9(12)11(4)6-2/h7-8H,5-6,10H2,1-4H3
InChIKeyIUVAYAARSQMGGM-UHFFFAOYSA-N
MW172.27 g/mol
LogP0.84
Rot. Bonds4

About 2-amino-N-ethyl-N,3-dimethylpentanamide

2-amino-N-ethyl-N,3-dimethylpentanamide (PubChem CID 23595882) has the molecular formula C9H20N2O and a molecular weight of 172.27 g/mol. Its IUPAC name is 2-amino-N-ethyl-N,3-dimethylpentanamide.

Molecular Properties

Compound Name2-amino-N-ethyl-N,3-dimethylpentanamide
PubChem CID23595882
Molecular FormulaC9H20N2O
Molecular Weight172.27 g/mol
Exact Mass172.16
IUPAC Name2-amino-N-ethyl-N,3-dimethylpentanamide
SMILESCCC(C)C(N)C(=O)N(C)CC
InChIInChI=1S/C9H20N2O/c1-5-7(3)8(10)9(12)11(4)6-2/h7-8H,5-6,10H2,1-4H3
InChIKeyIUVAYAARSQMGGM-UHFFFAOYSA-N
XLogP0.84
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-ethyl-N,3-dimethylpentanamide?
The IUPAC name of 2-amino-N-ethyl-N,3-dimethylpentanamide (CID 23595882) is 2-amino-N-ethyl-N,3-dimethylpentanamide.
What is the SMILES notation for 2-amino-N-ethyl-N,3-dimethylpentanamide?
The canonical SMILES for 2-amino-N-ethyl-N,3-dimethylpentanamide is CCC(C)C(N)C(=O)N(C)CC.
What is the InChIKey of 2-amino-N-ethyl-N,3-dimethylpentanamide?
The InChIKey is IUVAYAARSQMGGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O/c1-5-7(3)8(10)9(12)11(4)6-2/h7-8H,5-6,10H2,1-4H3.
What are the key properties of 2-amino-N-ethyl-N,3-dimethylpentanamide?
2-amino-N-ethyl-N,3-dimethylpentanamide has a molecular weight of 172.27 g/mol, XLogP of 0.84, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-ethyl-N,3-dimethylpentanamide is sourced from PubChem (CID 23595882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).