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

C5H14ClNO — CID 75481498

IUPAC3-methoxy-2-methylpropan-1-amine;hydrochloride
SMILESCOCC(C)CN.Cl
InChIInChI=1S/C5H13NO.ClH/c1-5(3-6)4-7-2;/h5H,3-4,6H2,1-2H3;1H
InChIKeyMJRNKLMYQIGQFV-UHFFFAOYSA-N
MW139.63 g/mol
LogP0.65
Rot. Bonds3

About 3-methoxy-2-methylpropan-1-amine;hydrochloride

3-methoxy-2-methylpropan-1-amine;hydrochloride (PubChem CID 75481498) has the molecular formula C5H14ClNO and a molecular weight of 139.63 g/mol. Its IUPAC name is 3-methoxy-2-methylpropan-1-amine;hydrochloride.

Molecular Properties

Compound Name3-methoxy-2-methylpropan-1-amine;hydrochloride
PubChem CID75481498
Molecular FormulaC5H14ClNO
Molecular Weight139.63 g/mol
Exact Mass139.08
IUPAC Name3-methoxy-2-methylpropan-1-amine;hydrochloride
SMILESCOCC(C)CN.Cl
InChIInChI=1S/C5H13NO.ClH/c1-5(3-6)4-7-2;/h5H,3-4,6H2,1-2H3;1H
InChIKeyMJRNKLMYQIGQFV-UHFFFAOYSA-N
XLogP0.65
TPSA35.25 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 ≤ 50.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-Methoxypropylamine
CID 1672
Propanolamine ethyl ether
CID 22720
3-Isobutoxypropylamine
CID 98668
(Oxetan-3-yl)methanamine
CID 46840007
3-Propoxypropylamine
CID 85579
3-Methoxy-2-methylpropan-1-amine
CID 22052176
3-Methoxy-2,2-dimethylpropan-1-amine
CID 28064871
3-Ethoxy-2-methylpropan-1-amine
CID 43175050
3-Methoxy-2,2-dimethylpropan-1-amine hydrochloride
CID 46782157
3-Methoxy-2-(methoxymethyl)propan-1-amine
CID 91047226
2-(Aminomethyl)-1,3-dimethoxypropane hydrochloride
CID 154577691
3,3,3-Trifluoro-2-(methoxymethyl)propan-1-amine;hydrochloride
CID 170911746

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-2-methylpropan-1-amine;hydrochloride?
The IUPAC name of 3-methoxy-2-methylpropan-1-amine;hydrochloride (CID 75481498) is 3-methoxy-2-methylpropan-1-amine;hydrochloride.
What is the SMILES notation for 3-methoxy-2-methylpropan-1-amine;hydrochloride?
The canonical SMILES for 3-methoxy-2-methylpropan-1-amine;hydrochloride is COCC(C)CN.Cl.
What is the InChIKey of 3-methoxy-2-methylpropan-1-amine;hydrochloride?
The InChIKey is MJRNKLMYQIGQFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13NO.ClH/c1-5(3-6)4-7-2;/h5H,3-4,6H2,1-2H3;1H.
What are the key properties of 3-methoxy-2-methylpropan-1-amine;hydrochloride?
3-methoxy-2-methylpropan-1-amine;hydrochloride has a molecular weight of 139.63 g/mol, XLogP of 0.65, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-2-methylpropan-1-amine;hydrochloride is sourced from PubChem (CID 75481498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).