N-methyl-2-(oxolan-3-yl)-1-pyridin-3-ylethanamine

C12H18N2O — CID 103986918

IUPACN-methyl-2-(oxolan-3-yl)-1-pyridin-3-ylethanamine
SMILESCNC(CC1CCOC1)c1cccnc1
InChIInChI=1S/C12H18N2O/c1-13-12(7-10-4-6-15-9-10)11-3-2-5-14-8-11/h2-3,5,8,10,12-13H,4,6-7,9H2,1H3
InChIKeyABZMKUDFLKKPMS-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.77
Rot. Bonds4

About N-methyl-2-(oxolan-3-yl)-1-pyridin-3-ylethanamine

N-methyl-2-(oxolan-3-yl)-1-pyridin-3-ylethanamine (PubChem CID 103986918) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is N-methyl-2-(oxolan-3-yl)-1-pyridin-3-ylethanamine.

Molecular Properties

Compound NameN-methyl-2-(oxolan-3-yl)-1-pyridin-3-ylethanamine
PubChem CID103986918
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC NameN-methyl-2-(oxolan-3-yl)-1-pyridin-3-ylethanamine
SMILESCNC(CC1CCOC1)c1cccnc1
InChIInChI=1S/C12H18N2O/c1-13-12(7-10-4-6-15-9-10)11-3-2-5-14-8-11/h2-3,5,8,10,12-13H,4,6-7,9H2,1H3
InChIKeyABZMKUDFLKKPMS-UHFFFAOYSA-N
XLogP1.77
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-2-(oxolan-3-yl)-1-pyridin-3-ylethanamine
CID 103987178
N-methyl-2-(oxolan-3-yl)-1-pyrazin-2-ylethanamine
CID 103986939
3-[1-(methylamino)-2-(oxolan-3-yl)ethyl]pyridin-4-amine
CID 103987130
1-(3-cyclobutylphenyl)-N-methyl-2-(oxolan-3-yl)ethanamine
CID 114604522
1-(3-ethoxyphenyl)-N-methyl-2-(oxolan-3-yl)ethanamine
CID 113362131
N-methyl-2-(oxolan-3-yl)-1-[3-(trifluoromethyl)phenyl]ethanamine
CID 103986937
N-methyl-1-(1-methylpyrazol-4-yl)-2-(oxolan-3-yl)ethanamine
CID 103986903
2-(3,4-dihydro-2H-chromen-4-yl)-N-methyl-1-pyridin-3-ylethanamine
CID 104770146
1-[2-(oxolan-3-yl)-1-phenylethyl]-3-pyridin-3-ylurea
CID 166181225
1-(furan-3-yl)-N-methyl-2-(oxolan-3-yl)ethanamine
CID 103987114
N-methyl-1-pyridin-3-yl-2-pyrrolidin-2-ylethanamine
CID 116951508
1-(oxolan-3-yl)-3-pyridin-3-ylpropan-2-ol
CID 104736202

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(oxolan-3-yl)-1-pyridin-3-ylethanamine?
The IUPAC name of N-methyl-2-(oxolan-3-yl)-1-pyridin-3-ylethanamine (CID 103986918) is N-methyl-2-(oxolan-3-yl)-1-pyridin-3-ylethanamine.
What is the SMILES notation for N-methyl-2-(oxolan-3-yl)-1-pyridin-3-ylethanamine?
The canonical SMILES for N-methyl-2-(oxolan-3-yl)-1-pyridin-3-ylethanamine is CNC(CC1CCOC1)c1cccnc1.
What is the InChIKey of N-methyl-2-(oxolan-3-yl)-1-pyridin-3-ylethanamine?
The InChIKey is ABZMKUDFLKKPMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c1-13-12(7-10-4-6-15-9-10)11-3-2-5-14-8-11/h2-3,5,8,10,12-13H,4,6-7,9H2,1H3.
What are the key properties of N-methyl-2-(oxolan-3-yl)-1-pyridin-3-ylethanamine?
N-methyl-2-(oxolan-3-yl)-1-pyridin-3-ylethanamine has a molecular weight of 206.29 g/mol, XLogP of 1.77, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(oxolan-3-yl)-1-pyridin-3-ylethanamine is sourced from PubChem (CID 103986918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).