2-amino-N,N,4-trimethylpentanamide;hydrochloride

C8H19ClN2O — CID 42944933

IUPAC2-amino-N,N,4-trimethylpentanamide;hydrochloride
SMILESCC(C)CC(N)C(=O)N(C)C.Cl
InChIInChI=1S/C8H18N2O.ClH/c1-6(2)5-7(9)8(11)10(3)4;/h6-7H,5,9H2,1-4H3;1H
InChIKeyWBAHRUNBZZZHKT-UHFFFAOYSA-N
MW194.71 g/mol
LogP0.87
Rot. Bonds3

About 2-amino-N,N,4-trimethylpentanamide;hydrochloride

2-amino-N,N,4-trimethylpentanamide;hydrochloride (PubChem CID 42944933) has the molecular formula C8H19ClN2O and a molecular weight of 194.71 g/mol. Its IUPAC name is 2-amino-N,N,4-trimethylpentanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N,N,4-trimethylpentanamide;hydrochloride
PubChem CID42944933
Molecular FormulaC8H19ClN2O
Molecular Weight194.71 g/mol
Exact Mass194.12
IUPAC Name2-amino-N,N,4-trimethylpentanamide;hydrochloride
SMILESCC(C)CC(N)C(=O)N(C)C.Cl
InChIInChI=1S/C8H18N2O.ClH/c1-6(2)5-7(9)8(11)10(3)4;/h6-7H,5,9H2,1-4H3;1H
InChIKeyWBAHRUNBZZZHKT-UHFFFAOYSA-N
XLogP0.87
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.71
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N,N,4-trimethylpentanamide;hydrochloride?
The IUPAC name of 2-amino-N,N,4-trimethylpentanamide;hydrochloride (CID 42944933) is 2-amino-N,N,4-trimethylpentanamide;hydrochloride.
What is the SMILES notation for 2-amino-N,N,4-trimethylpentanamide;hydrochloride?
The canonical SMILES for 2-amino-N,N,4-trimethylpentanamide;hydrochloride is CC(C)CC(N)C(=O)N(C)C.Cl.
What is the InChIKey of 2-amino-N,N,4-trimethylpentanamide;hydrochloride?
The InChIKey is WBAHRUNBZZZHKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O.ClH/c1-6(2)5-7(9)8(11)10(3)4;/h6-7H,5,9H2,1-4H3;1H.
What are the key properties of 2-amino-N,N,4-trimethylpentanamide;hydrochloride?
2-amino-N,N,4-trimethylpentanamide;hydrochloride has a molecular weight of 194.71 g/mol, XLogP of 0.87, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N,N,4-trimethylpentanamide;hydrochloride is sourced from PubChem (CID 42944933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).