N-ethyl-N-propan-2-ylpropan-2-amine;hydrochloride

C8H20ClN — CID 10997398

IUPACN-ethyl-N-propan-2-ylpropan-2-amine;hydrochloride
SMILESCCN(C(C)C)C(C)C.Cl
InChIInChI=1S/C8H19N.ClH/c1-6-9(7(2)3)8(4)5;/h7-8H,6H2,1-5H3;1H
InChIKeyOZECFIJVSAYAPH-UHFFFAOYSA-N
MW165.71 g/mol
LogP2.55
Rot. Bonds3

About N-ethyl-N-propan-2-ylpropan-2-amine;hydrochloride

N-ethyl-N-propan-2-ylpropan-2-amine;hydrochloride (PubChem CID 10997398) has the molecular formula C8H20ClN and a molecular weight of 165.71 g/mol. Its IUPAC name is N-ethyl-N-propan-2-ylpropan-2-amine;hydrochloride.

Molecular Properties

Compound NameN-ethyl-N-propan-2-ylpropan-2-amine;hydrochloride
PubChem CID10997398
Molecular FormulaC8H20ClN
Molecular Weight165.71 g/mol
Exact Mass165.13
IUPAC NameN-ethyl-N-propan-2-ylpropan-2-amine;hydrochloride
SMILESCCN(C(C)C)C(C)C.Cl
InChIInChI=1S/C8H19N.ClH/c1-6-9(7(2)3)8(4)5;/h7-8H,6H2,1-5H3;1H
InChIKeyOZECFIJVSAYAPH-UHFFFAOYSA-N
XLogP2.55
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.71
LogP ≤ 52.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze N-ethyl-N-propan-2-ylpropan-2-amine;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-propan-2-ylpropan-2-amine;hydrochloride?
The IUPAC name of N-ethyl-N-propan-2-ylpropan-2-amine;hydrochloride (CID 10997398) is N-ethyl-N-propan-2-ylpropan-2-amine;hydrochloride.
What is the SMILES notation for N-ethyl-N-propan-2-ylpropan-2-amine;hydrochloride?
The canonical SMILES for N-ethyl-N-propan-2-ylpropan-2-amine;hydrochloride is CCN(C(C)C)C(C)C.Cl.
What is the InChIKey of N-ethyl-N-propan-2-ylpropan-2-amine;hydrochloride?
The InChIKey is OZECFIJVSAYAPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19N.ClH/c1-6-9(7(2)3)8(4)5;/h7-8H,6H2,1-5H3;1H.
What are the key properties of N-ethyl-N-propan-2-ylpropan-2-amine;hydrochloride?
N-ethyl-N-propan-2-ylpropan-2-amine;hydrochloride has a molecular weight of 165.71 g/mol, XLogP of 2.55, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-propan-2-ylpropan-2-amine;hydrochloride is sourced from PubChem (CID 10997398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).