N-methyl-1-(oxolan-2-yl)methanamine;hydrochloride

C6H14ClNO — CID 521225

IUPACN-methyl-1-(oxolan-2-yl)methanamine;hydrochloride
SMILESCNCC1CCCO1.Cl
InChIInChI=1S/C6H13NO.ClH/c1-7-5-6-3-2-4-8-6;/h6-7H,2-5H2,1H3;1H
InChIKeyQWNGJJUPXCQCRM-UHFFFAOYSA-N
MW151.64 g/mol
LogP0.81
Rot. Bonds2

About N-methyl-1-(oxolan-2-yl)methanamine;hydrochloride

N-methyl-1-(oxolan-2-yl)methanamine;hydrochloride (PubChem CID 521225) has the molecular formula C6H14ClNO and a molecular weight of 151.64 g/mol. Its IUPAC name is N-methyl-1-(oxolan-2-yl)methanamine;hydrochloride.

Molecular Properties

Compound NameN-methyl-1-(oxolan-2-yl)methanamine;hydrochloride
PubChem CID521225
Molecular FormulaC6H14ClNO
Molecular Weight151.64 g/mol
Exact Mass151.08
IUPAC NameN-methyl-1-(oxolan-2-yl)methanamine;hydrochloride
SMILESCNCC1CCCO1.Cl
InChIInChI=1S/C6H13NO.ClH/c1-7-5-6-3-2-4-8-6;/h6-7H,2-5H2,1H3;1H
InChIKeyQWNGJJUPXCQCRM-UHFFFAOYSA-N
XLogP0.81
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.64
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(Tetrahydrofurfuryl)-N-methylamine
CID 98090
N-Ethyltetrahydrofurfurylamine
CID 98295
Isopropyl-(tetrahydro-furan-2-ylmethyl)-amine
CID 263171
N-(oxolan-2-ylmethyl)butan-1-amine
CID 263177
methyl({[(2R)-oxolan-2-yl]methyl})amine
CID 41098313
methyl((((2S)-oxolan-2-yl)methyl))amine
CID 41098315
Methyl(1-(oxolan-2-yl)ethyl)amine
CID 43534145
N-methyl-1-(2-methyloxolan-2-yl)methanamine
CID 111270
Propyl-(tetrahydro-furan-2-ylmethyl)-amine
CID 3144565
N-tetrahydrofurfurylethylenediamine
CID 13802796
((3,3-Dimethyloxolan-2-yl)methyl)(methyl)amine hydrochloride
CID 165807565
[(4,4-Difluorooxolan-2-yl)methyl](methyl)amine
CID 177808931

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(oxolan-2-yl)methanamine;hydrochloride?
The IUPAC name of N-methyl-1-(oxolan-2-yl)methanamine;hydrochloride (CID 521225) is N-methyl-1-(oxolan-2-yl)methanamine;hydrochloride.
What is the SMILES notation for N-methyl-1-(oxolan-2-yl)methanamine;hydrochloride?
The canonical SMILES for N-methyl-1-(oxolan-2-yl)methanamine;hydrochloride is CNCC1CCCO1.Cl.
What is the InChIKey of N-methyl-1-(oxolan-2-yl)methanamine;hydrochloride?
The InChIKey is QWNGJJUPXCQCRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO.ClH/c1-7-5-6-3-2-4-8-6;/h6-7H,2-5H2,1H3;1H.
What are the key properties of N-methyl-1-(oxolan-2-yl)methanamine;hydrochloride?
N-methyl-1-(oxolan-2-yl)methanamine;hydrochloride has a molecular weight of 151.64 g/mol, XLogP of 0.81, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(oxolan-2-yl)methanamine;hydrochloride is sourced from PubChem (CID 521225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).