N-methyl-1-[5-(pyrrolidin-1-ylmethyl)oxolan-2-yl]methanamine

C11H22N2O — CID 62437708

IUPACN-methyl-1-[5-(pyrrolidin-1-ylmethyl)oxolan-2-yl]methanamine
SMILESCNCC1CCC(CN2CCCC2)O1
InChIInChI=1S/C11H22N2O/c1-12-8-10-4-5-11(14-10)9-13-6-2-3-7-13/h10-12H,2-9H2,1H3
InChIKeyWAQAMBNCZDIFCD-UHFFFAOYSA-N
MW198.31 g/mol
LogP0.85
Rot. Bonds4

About N-methyl-1-[5-(pyrrolidin-1-ylmethyl)oxolan-2-yl]methanamine

N-methyl-1-[5-(pyrrolidin-1-ylmethyl)oxolan-2-yl]methanamine (PubChem CID 62437708) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is N-methyl-1-[5-(pyrrolidin-1-ylmethyl)oxolan-2-yl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[5-(pyrrolidin-1-ylmethyl)oxolan-2-yl]methanamine
PubChem CID62437708
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC NameN-methyl-1-[5-(pyrrolidin-1-ylmethyl)oxolan-2-yl]methanamine
SMILESCNCC1CCC(CN2CCCC2)O1
InChIInChI=1S/C11H22N2O/c1-12-8-10-4-5-11(14-10)9-13-6-2-3-7-13/h10-12H,2-9H2,1H3
InChIKeyWAQAMBNCZDIFCD-UHFFFAOYSA-N
XLogP0.85
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[5-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]oxolan-2-yl]-N-methylmethanamine
CID 62412100
N-[[5-(pyrrolidin-1-ylmethyl)oxolan-2-yl]methyl]propan-2-amine
CID 62437899
N-methyl-1-[5-[(2-methyl-1,4-oxazepan-4-yl)methyl]oxolan-2-yl]methanamine
CID 55140178
1-[5-[(3-methoxypyrrolidin-1-yl)methyl]oxolan-2-yl]-N-methylmethanamine
CID 103539697
N,N-diethyl-1-[[5-(methylaminomethyl)oxolan-2-yl]methyl]pyrrolidin-3-amine
CID 63166921
1-[5-[[2-[(dimethylamino)methyl]pyrrolidin-1-yl]methyl]oxolan-2-yl]-N-methylmethanamine
CID 62888537
N-methyl-1-[5-[(2,2,6-trimethylmorpholin-4-yl)methyl]oxolan-2-yl]methanamine
CID 62436334
N-[[5-[(4-methylpiperazin-1-yl)methyl]oxolan-2-yl]methyl]ethanamine
CID 55069730
N-[[5-[(4-tert-butylpiperazin-1-yl)methyl]oxolan-2-yl]methyl]propan-2-amine
CID 62463360
1-[5-[(dimethylamino)methyl]oxolan-2-yl]-N-methylmethanamine
CID 62419753
1-[[5-[(tert-butylamino)methyl]oxolan-2-yl]methyl]-N,N-dimethylpiperidin-4-amine
CID 62433914
N-methyl-1-[5-[(2,3,5-trimethylpiperidin-1-yl)methyl]oxolan-2-yl]methanamine
CID 114597089

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[5-(pyrrolidin-1-ylmethyl)oxolan-2-yl]methanamine?
The IUPAC name of N-methyl-1-[5-(pyrrolidin-1-ylmethyl)oxolan-2-yl]methanamine (CID 62437708) is N-methyl-1-[5-(pyrrolidin-1-ylmethyl)oxolan-2-yl]methanamine.
What is the SMILES notation for N-methyl-1-[5-(pyrrolidin-1-ylmethyl)oxolan-2-yl]methanamine?
The canonical SMILES for N-methyl-1-[5-(pyrrolidin-1-ylmethyl)oxolan-2-yl]methanamine is CNCC1CCC(CN2CCCC2)O1.
What is the InChIKey of N-methyl-1-[5-(pyrrolidin-1-ylmethyl)oxolan-2-yl]methanamine?
The InChIKey is WAQAMBNCZDIFCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-12-8-10-4-5-11(14-10)9-13-6-2-3-7-13/h10-12H,2-9H2,1H3.
What are the key properties of N-methyl-1-[5-(pyrrolidin-1-ylmethyl)oxolan-2-yl]methanamine?
N-methyl-1-[5-(pyrrolidin-1-ylmethyl)oxolan-2-yl]methanamine has a molecular weight of 198.31 g/mol, XLogP of 0.85, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[5-(pyrrolidin-1-ylmethyl)oxolan-2-yl]methanamine is sourced from PubChem (CID 62437708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).