N-methyl-N-[(4-methylpyrrolidin-3-yl)methyl]oxolan-3-amine

C11H22N2O — CID 82739455

IUPACN-methyl-N-[(4-methylpyrrolidin-3-yl)methyl]oxolan-3-amine
SMILESCC1CNCC1CN(C)C1CCOC1
InChIInChI=1S/C11H22N2O/c1-9-5-12-6-10(9)7-13(2)11-3-4-14-8-11/h9-12H,3-8H2,1-2H3
InChIKeyQGIJGBNFCROKAG-UHFFFAOYSA-N
MW198.31 g/mol
LogP0.56
Rot. Bonds3

About N-methyl-N-[(4-methylpyrrolidin-3-yl)methyl]oxolan-3-amine

N-methyl-N-[(4-methylpyrrolidin-3-yl)methyl]oxolan-3-amine (PubChem CID 82739455) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is N-methyl-N-[(4-methylpyrrolidin-3-yl)methyl]oxolan-3-amine.

Molecular Properties

Compound NameN-methyl-N-[(4-methylpyrrolidin-3-yl)methyl]oxolan-3-amine
PubChem CID82739455
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC NameN-methyl-N-[(4-methylpyrrolidin-3-yl)methyl]oxolan-3-amine
SMILESCC1CNCC1CN(C)C1CCOC1
InChIInChI=1S/C11H22N2O/c1-9-5-12-6-10(9)7-13(2)11-3-4-14-8-11/h9-12H,3-8H2,1-2H3
InChIKeyQGIJGBNFCROKAG-UHFFFAOYSA-N
XLogP0.56
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-2-[[methyl(oxolan-3-yl)amino]methyl]cyclohexan-1-ol
CID 82754506
N-[(2-amino-5-methylcyclohexyl)methyl]-N-methyloxolan-3-amine
CID 82744259
N-methyl-N-(oxolan-3-yl)azetidin-3-amine
CID 66187761
N,N-dimethyl-3-[[methyl(oxan-4-yl)amino]methyl]oxan-4-amine
CID 143952966
N-ethyl-4-[[methyl(oxolan-3-yl)amino]methyl]oxolan-3-amine
CID 82739733
N-methyl-N-[[(2S)-pyrrolidin-2-yl]methyl]oxolan-3-amine
CID 104870205
N-methyl-N-(pyrrolidin-2-ylmethyl)oxolan-3-amine
CID 82739396
N,N'-dimethyl-N,N'-bis[(3S)-oxolan-3-yl]but-2-yne-1,4-diamine
CID 124729941
N-[[5-ethyl-2-(methylamino)cyclohexyl]methyl]-N-methyloxolan-3-amine
CID 82744252
N-[(3-bromocyclobutyl)methyl]-N-methyloxolan-3-amine
CID 80690224
N-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-methyloxolan-3-amine
CID 82743146
N-methyl-N-[(4-methylpyrrolidin-3-yl)methyl]-1-(oxolan-2-yl)methanamine
CID 63714376

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(4-methylpyrrolidin-3-yl)methyl]oxolan-3-amine?
The IUPAC name of N-methyl-N-[(4-methylpyrrolidin-3-yl)methyl]oxolan-3-amine (CID 82739455) is N-methyl-N-[(4-methylpyrrolidin-3-yl)methyl]oxolan-3-amine.
What is the SMILES notation for N-methyl-N-[(4-methylpyrrolidin-3-yl)methyl]oxolan-3-amine?
The canonical SMILES for N-methyl-N-[(4-methylpyrrolidin-3-yl)methyl]oxolan-3-amine is CC1CNCC1CN(C)C1CCOC1.
What is the InChIKey of N-methyl-N-[(4-methylpyrrolidin-3-yl)methyl]oxolan-3-amine?
The InChIKey is QGIJGBNFCROKAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-9-5-12-6-10(9)7-13(2)11-3-4-14-8-11/h9-12H,3-8H2,1-2H3.
What are the key properties of N-methyl-N-[(4-methylpyrrolidin-3-yl)methyl]oxolan-3-amine?
N-methyl-N-[(4-methylpyrrolidin-3-yl)methyl]oxolan-3-amine has a molecular weight of 198.31 g/mol, XLogP of 0.56, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(4-methylpyrrolidin-3-yl)methyl]oxolan-3-amine is sourced from PubChem (CID 82739455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).