N-methoxy-1-(3-methyloxetan-3-yl)methanamine;hydrochloride

C6H14ClNO2 — CID 102571545

IUPACN-methoxy-1-(3-methyloxetan-3-yl)methanamine;hydrochloride
SMILESCONCC1(C)COC1.Cl
InChIInChI=1S/C6H13NO2.ClH/c1-6(3-7-8-2)4-9-5-6;/h7H,3-5H2,1-2H3;1H
InChIKeyZTFMFHXEVVTIOC-UHFFFAOYSA-N
MW167.64 g/mol
LogP0.60
Rot. Bonds3

About N-methoxy-1-(3-methyloxetan-3-yl)methanamine;hydrochloride

N-methoxy-1-(3-methyloxetan-3-yl)methanamine;hydrochloride (PubChem CID 102571545) has the molecular formula C6H14ClNO2 and a molecular weight of 167.64 g/mol. Its IUPAC name is N-methoxy-1-(3-methyloxetan-3-yl)methanamine;hydrochloride.

Molecular Properties

Compound NameN-methoxy-1-(3-methyloxetan-3-yl)methanamine;hydrochloride
PubChem CID102571545
Molecular FormulaC6H14ClNO2
Molecular Weight167.64 g/mol
Exact Mass167.07
IUPAC NameN-methoxy-1-(3-methyloxetan-3-yl)methanamine;hydrochloride
SMILESCONCC1(C)COC1.Cl
InChIInChI=1S/C6H13NO2.ClH/c1-6(3-7-8-2)4-9-5-6;/h7H,3-5H2,1-2H3;1H
InChIKeyZTFMFHXEVVTIOC-UHFFFAOYSA-N
XLogP0.60
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.64
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(3-Methyloxetan-3-yl)methanamine hydrochloride
CID 68386175
1-(3-methyloxetan-3-yl)-N-(2,2,2-trifluoroethoxy)methanamine
CID 82722494
[3-(Methoxymethyl)oxetan-3-yl]methanamine
CID 83904841
N-chloro-1-(3-methyloxetan-3-yl)methanamine
CID 88991162
N-methoxy-1-(3-methyloxetan-3-yl)methanamine
CID 64973763
N-ethoxy-1-(3-methyloxetan-3-yl)methanamine
CID 64974379
1-(3-methyloxetan-3-yl)-N-(2-methylpropoxy)methanamine
CID 82714954
N-(2-methoxyethoxy)-1-(3-methyloxetan-3-yl)methanamine
CID 82722399
1-(3-methyloxetan-3-yl)-N-[(2-methylpropan-2-yl)oxy]methanamine
CID 82724317
N-[(3-methyloxetan-3-yl)methyl]hydroxylamine
CID 107236061
1-(3-methyloxetan-3-yl)-N-prop-2-ynoxymethanamine
CID 131222813
1-(3-methyloxetan-3-yl)-N-propan-2-yloxymethanamine
CID 131223094

Frequently Asked Questions

What is the IUPAC name of N-methoxy-1-(3-methyloxetan-3-yl)methanamine;hydrochloride?
The IUPAC name of N-methoxy-1-(3-methyloxetan-3-yl)methanamine;hydrochloride (CID 102571545) is N-methoxy-1-(3-methyloxetan-3-yl)methanamine;hydrochloride.
What is the SMILES notation for N-methoxy-1-(3-methyloxetan-3-yl)methanamine;hydrochloride?
The canonical SMILES for N-methoxy-1-(3-methyloxetan-3-yl)methanamine;hydrochloride is CONCC1(C)COC1.Cl.
What is the InChIKey of N-methoxy-1-(3-methyloxetan-3-yl)methanamine;hydrochloride?
The InChIKey is ZTFMFHXEVVTIOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO2.ClH/c1-6(3-7-8-2)4-9-5-6;/h7H,3-5H2,1-2H3;1H.
What are the key properties of N-methoxy-1-(3-methyloxetan-3-yl)methanamine;hydrochloride?
N-methoxy-1-(3-methyloxetan-3-yl)methanamine;hydrochloride has a molecular weight of 167.64 g/mol, XLogP of 0.60, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-1-(3-methyloxetan-3-yl)methanamine;hydrochloride is sourced from PubChem (CID 102571545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).