3-methoxy-2-(methoxymethyl)propan-1-amine;hydrochloride

C6H16ClNO2 — CID 154577691

IUPAC3-methoxy-2-(methoxymethyl)propan-1-amine;hydrochloride
SMILESCOCC(CN)COC.Cl
InChIInChI=1S/C6H15NO2.ClH/c1-8-4-6(3-7)5-9-2;/h6H,3-5,7H2,1-2H3;1H
InChIKeyAGECYWXFCGSQGW-UHFFFAOYSA-N
MW169.65 g/mol
LogP0.28
Rot. Bonds5

About 3-methoxy-2-(methoxymethyl)propan-1-amine;hydrochloride

3-methoxy-2-(methoxymethyl)propan-1-amine;hydrochloride (PubChem CID 154577691) has the molecular formula C6H16ClNO2 and a molecular weight of 169.65 g/mol. Its IUPAC name is 3-methoxy-2-(methoxymethyl)propan-1-amine;hydrochloride.

Molecular Properties

Compound Name3-methoxy-2-(methoxymethyl)propan-1-amine;hydrochloride
PubChem CID154577691
Molecular FormulaC6H16ClNO2
Molecular Weight169.65 g/mol
Exact Mass169.09
IUPAC Name3-methoxy-2-(methoxymethyl)propan-1-amine;hydrochloride
SMILESCOCC(CN)COC.Cl
InChIInChI=1S/C6H15NO2.ClH/c1-8-4-6(3-7)5-9-2;/h6H,3-5,7H2,1-2H3;1H
InChIKeyAGECYWXFCGSQGW-UHFFFAOYSA-N
XLogP0.28
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.65
LogP ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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1-methoxy-2-(methoxymethyl)butane
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2-(aminomethyl)-4-methoxybutan-1-ol
CID 63216338
(2S,3S)-1,4-dimethoxybutane-2,3-diamine
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2,4-dimethoxy-3-methylbutan-1-amine
CID 116503390
3-methoxy-2-N,2-N-bis(prop-2-enyl)propane-1,2-diamine
CID 103225187
4-ethyl-1-methoxy-2-(methoxymethyl)hexane
CID 174960180
3-fluoro-4-methoxy-2-propan-2-ylbutan-1-amine
CID 107443598
3-(aminomethyl)-4-methoxybutan-2-one
CID 59279706
6-methoxy-2-methylhexan-1-amine
CID 64666005

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-2-(methoxymethyl)propan-1-amine;hydrochloride?
The IUPAC name of 3-methoxy-2-(methoxymethyl)propan-1-amine;hydrochloride (CID 154577691) is 3-methoxy-2-(methoxymethyl)propan-1-amine;hydrochloride.
What is the SMILES notation for 3-methoxy-2-(methoxymethyl)propan-1-amine;hydrochloride?
The canonical SMILES for 3-methoxy-2-(methoxymethyl)propan-1-amine;hydrochloride is COCC(CN)COC.Cl.
What is the InChIKey of 3-methoxy-2-(methoxymethyl)propan-1-amine;hydrochloride?
The InChIKey is AGECYWXFCGSQGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15NO2.ClH/c1-8-4-6(3-7)5-9-2;/h6H,3-5,7H2,1-2H3;1H.
What are the key properties of 3-methoxy-2-(methoxymethyl)propan-1-amine;hydrochloride?
3-methoxy-2-(methoxymethyl)propan-1-amine;hydrochloride has a molecular weight of 169.65 g/mol, XLogP of 0.28, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-2-(methoxymethyl)propan-1-amine;hydrochloride is sourced from PubChem (CID 154577691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).