5-methyl-3-[1-(methylamino)-2-(oxolan-3-yl)ethyl]pyridin-2-amine

C13H21N3O — CID 113362130

IUPAC5-methyl-3-[1-(methylamino)-2-(oxolan-3-yl)ethyl]pyridin-2-amine
SMILESCNC(CC1CCOC1)c1cc(C)cnc1N
InChIInChI=1S/C13H21N3O/c1-9-5-11(13(14)16-7-9)12(15-2)6-10-3-4-17-8-10/h5,7,10,12,15H,3-4,6,8H2,1-2H3,(H2,14,16)
InChIKeyRXSAOWJWMOXFKJ-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.66
Rot. Bonds4

About 5-methyl-3-[1-(methylamino)-2-(oxolan-3-yl)ethyl]pyridin-2-amine

5-methyl-3-[1-(methylamino)-2-(oxolan-3-yl)ethyl]pyridin-2-amine (PubChem CID 113362130) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is 5-methyl-3-[1-(methylamino)-2-(oxolan-3-yl)ethyl]pyridin-2-amine.

Molecular Properties

Compound Name5-methyl-3-[1-(methylamino)-2-(oxolan-3-yl)ethyl]pyridin-2-amine
PubChem CID113362130
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC Name5-methyl-3-[1-(methylamino)-2-(oxolan-3-yl)ethyl]pyridin-2-amine
SMILESCNC(CC1CCOC1)c1cc(C)cnc1N
InChIInChI=1S/C13H21N3O/c1-9-5-11(13(14)16-7-9)12(15-2)6-10-3-4-17-8-10/h5,7,10,12,15H,3-4,6,8H2,1-2H3,(H2,14,16)
InChIKeyRXSAOWJWMOXFKJ-UHFFFAOYSA-N
XLogP1.66
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2,5-dimethylphenyl)-N-methyl-2-(oxolan-3-yl)ethanamine
CID 113362110
N-methyl-2-(oxolan-3-yl)-1-(2,4,5-trimethylphenyl)ethanamine
CID 113362151
3-[1-(methylamino)-2-(oxolan-3-yl)ethyl]pyridin-4-amine
CID 103987130
N-methyl-2-(oxolan-3-yl)-1-pyrazin-2-ylethanamine
CID 103986939
3-(1-amino-2-cyclopropylethyl)-5-methylpyridin-2-amine
CID 55295743
[1-(3,5-dimethyl-2-pyridinyl)-2-(oxan-4-yl)ethyl]hydrazine
CID 105266326
N-methyl-1-(1-methylpyrazol-4-yl)-2-(oxolan-3-yl)ethanamine
CID 103986903
5-methyl-2-(oxolan-3-ylmethoxy)pyridin-3-amine
CID 66280449
N-methyl-2-(oxolan-3-yl)-1-(3-phenyltriazol-4-yl)ethanamine
CID 114689023
3-[cyclooctyl(methylamino)methyl]-5-methylpyridin-2-amine
CID 80604124
N-methyl-2-(oxolan-3-yl)-1-pyridin-3-ylethanamine
CID 103986918
1-(3-ethoxyphenyl)-N-methyl-2-(oxolan-3-yl)ethanamine
CID 113362131

Frequently Asked Questions

What is the IUPAC name of 5-methyl-3-[1-(methylamino)-2-(oxolan-3-yl)ethyl]pyridin-2-amine?
The IUPAC name of 5-methyl-3-[1-(methylamino)-2-(oxolan-3-yl)ethyl]pyridin-2-amine (CID 113362130) is 5-methyl-3-[1-(methylamino)-2-(oxolan-3-yl)ethyl]pyridin-2-amine.
What is the SMILES notation for 5-methyl-3-[1-(methylamino)-2-(oxolan-3-yl)ethyl]pyridin-2-amine?
The canonical SMILES for 5-methyl-3-[1-(methylamino)-2-(oxolan-3-yl)ethyl]pyridin-2-amine is CNC(CC1CCOC1)c1cc(C)cnc1N.
What is the InChIKey of 5-methyl-3-[1-(methylamino)-2-(oxolan-3-yl)ethyl]pyridin-2-amine?
The InChIKey is RXSAOWJWMOXFKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-9-5-11(13(14)16-7-9)12(15-2)6-10-3-4-17-8-10/h5,7,10,12,15H,3-4,6,8H2,1-2H3,(H2,14,16).
What are the key properties of 5-methyl-3-[1-(methylamino)-2-(oxolan-3-yl)ethyl]pyridin-2-amine?
5-methyl-3-[1-(methylamino)-2-(oxolan-3-yl)ethyl]pyridin-2-amine has a molecular weight of 235.33 g/mol, XLogP of 1.66, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3-[1-(methylamino)-2-(oxolan-3-yl)ethyl]pyridin-2-amine is sourced from PubChem (CID 113362130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).