N,2-dimethyloxan-4-amine;hydrochloride

C7H16ClNO — CID 154857191

IUPACN,2-dimethyloxan-4-amine;hydrochloride
SMILESCNC1CCOC(C)C1.Cl
InChIInChI=1S/C7H15NO.ClH/c1-6-5-7(8-2)3-4-9-6;/h6-8H,3-5H2,1-2H3;1H
InChIKeyQSVPVHZUAAKFET-UHFFFAOYSA-N
MW165.66 g/mol
LogP1.20
Rot. Bonds1

About N,2-dimethyloxan-4-amine;hydrochloride

N,2-dimethyloxan-4-amine;hydrochloride (PubChem CID 154857191) has the molecular formula C7H16ClNO and a molecular weight of 165.66 g/mol. Its IUPAC name is N,2-dimethyloxan-4-amine;hydrochloride.

Molecular Properties

Compound NameN,2-dimethyloxan-4-amine;hydrochloride
PubChem CID154857191
Molecular FormulaC7H16ClNO
Molecular Weight165.66 g/mol
Exact Mass165.09
IUPAC NameN,2-dimethyloxan-4-amine;hydrochloride
SMILESCNC1CCOC(C)C1.Cl
InChIInChI=1S/C7H15NO.ClH/c1-6-5-7(8-2)3-4-9-6;/h6-8H,3-5H2,1-2H3;1H
InChIKeyQSVPVHZUAAKFET-UHFFFAOYSA-N
XLogP1.20
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.66
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,2-dimethyloxan-4-amine;hydrochloride?
The IUPAC name of N,2-dimethyloxan-4-amine;hydrochloride (CID 154857191) is N,2-dimethyloxan-4-amine;hydrochloride.
What is the SMILES notation for N,2-dimethyloxan-4-amine;hydrochloride?
The canonical SMILES for N,2-dimethyloxan-4-amine;hydrochloride is CNC1CCOC(C)C1.Cl.
What is the InChIKey of N,2-dimethyloxan-4-amine;hydrochloride?
The InChIKey is QSVPVHZUAAKFET-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO.ClH/c1-6-5-7(8-2)3-4-9-6;/h6-8H,3-5H2,1-2H3;1H.
What are the key properties of N,2-dimethyloxan-4-amine;hydrochloride?
N,2-dimethyloxan-4-amine;hydrochloride has a molecular weight of 165.66 g/mol, XLogP of 1.20, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyloxan-4-amine;hydrochloride is sourced from PubChem (CID 154857191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).