2-methoxy-N-methylpropan-1-amine;hydrochloride

C5H14ClNO — CID 25049826

IUPAC2-methoxy-N-methylpropan-1-amine;hydrochloride
SMILESCNCC(C)OC.Cl
InChIInChI=1S/C5H13NO.ClH/c1-5(7-3)4-6-2;/h5-6H,4H2,1-3H3;1H
InChIKeyPXTPJTWXYQKSBR-UHFFFAOYSA-N
MW139.63 g/mol
LogP0.66
Rot. Bonds3

About 2-methoxy-N-methylpropan-1-amine;hydrochloride

2-methoxy-N-methylpropan-1-amine;hydrochloride (PubChem CID 25049826) has the molecular formula C5H14ClNO and a molecular weight of 139.63 g/mol. Its IUPAC name is 2-methoxy-N-methylpropan-1-amine;hydrochloride.

Molecular Properties

Compound Name2-methoxy-N-methylpropan-1-amine;hydrochloride
PubChem CID25049826
Molecular FormulaC5H14ClNO
Molecular Weight139.63 g/mol
Exact Mass139.08
IUPAC Name2-methoxy-N-methylpropan-1-amine;hydrochloride
SMILESCNCC(C)OC.Cl
InChIInChI=1S/C5H13NO.ClH/c1-5(7-3)4-6-2;/h5-6H,4H2,1-3H3;1H
InChIKeyPXTPJTWXYQKSBR-UHFFFAOYSA-N
XLogP0.66
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.63
LogP ≤ 50.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-methylpropan-1-amine;hydrochloride?
The IUPAC name of 2-methoxy-N-methylpropan-1-amine;hydrochloride (CID 25049826) is 2-methoxy-N-methylpropan-1-amine;hydrochloride.
What is the SMILES notation for 2-methoxy-N-methylpropan-1-amine;hydrochloride?
The canonical SMILES for 2-methoxy-N-methylpropan-1-amine;hydrochloride is CNCC(C)OC.Cl.
What is the InChIKey of 2-methoxy-N-methylpropan-1-amine;hydrochloride?
The InChIKey is PXTPJTWXYQKSBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13NO.ClH/c1-5(7-3)4-6-2;/h5-6H,4H2,1-3H3;1H.
What are the key properties of 2-methoxy-N-methylpropan-1-amine;hydrochloride?
2-methoxy-N-methylpropan-1-amine;hydrochloride has a molecular weight of 139.63 g/mol, XLogP of 0.66, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-methylpropan-1-amine;hydrochloride is sourced from PubChem (CID 25049826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).