4-methyl-3-[methylamino(oxolan-3-yl)methyl]pyridin-2-amine

C12H19N3O — CID 65329909

IUPAC4-methyl-3-[methylamino(oxolan-3-yl)methyl]pyridin-2-amine
SMILESCNC(c1c(C)ccnc1N)C1CCOC1
InChIInChI=1S/C12H19N3O/c1-8-3-5-15-12(13)10(8)11(14-2)9-4-6-16-7-9/h3,5,9,11,14H,4,6-7H2,1-2H3,(H2,13,15)
InChIKeyZYZOLZJGXDCFJJ-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.27
Rot. Bonds3

About 4-methyl-3-[methylamino(oxolan-3-yl)methyl]pyridin-2-amine

4-methyl-3-[methylamino(oxolan-3-yl)methyl]pyridin-2-amine (PubChem CID 65329909) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is 4-methyl-3-[methylamino(oxolan-3-yl)methyl]pyridin-2-amine.

Molecular Properties

Compound Name4-methyl-3-[methylamino(oxolan-3-yl)methyl]pyridin-2-amine
PubChem CID65329909
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name4-methyl-3-[methylamino(oxolan-3-yl)methyl]pyridin-2-amine
SMILESCNC(c1c(C)ccnc1N)C1CCOC1
InChIInChI=1S/C12H19N3O/c1-8-3-5-15-12(13)10(8)11(14-2)9-4-6-16-7-9/h3,5,9,11,14H,4,6-7H2,1-2H3,(H2,13,15)
InChIKeyZYZOLZJGXDCFJJ-UHFFFAOYSA-N
XLogP1.27
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(4-ethylcyclohexyl)-(methylamino)methyl]-4-methylpyridin-2-amine
CID 65392904
1-(3,4-dimethylphenyl)-N-methyl-1-(oxolan-3-yl)methanamine
CID 61271037
4-methyl-3-[methylamino(thian-2-yl)methyl]pyridin-2-amine
CID 80627136
N-methyl-1-(2-methylfuran-3-yl)-1-(oxolan-3-yl)methanamine
CID 104789944
1-(5-chloro-2-methylphenyl)-N-methyl-1-(oxolan-3-yl)methanamine
CID 115856559
N-methyl-1-(2-methylpyrazol-3-yl)-1-(oxolan-3-yl)methanamine
CID 65330463
3-[(4-ethylcyclohexyl)-hydrazinylmethyl]-4-methylpyridin-2-amine
CID 105231546
1-(2-amino-4-methyl-3-pyridinyl)-2-cyclopropylethane-1,2-diol
CID 103456736
1-(4-fluoro-3,5-dimethylphenyl)-N-methyl-1-(oxolan-3-yl)methanamine
CID 65298857
1-(4-fluorophenyl)-N-methyl-1-(oxolan-3-yl)methanamine
CID 61273212
N-[(2-methylphenyl)-(oxolan-3-yl)methyl]ethanamine
CID 63563797
1-(2,5-dibromo-4-methylphenyl)-N-methyl-1-(oxolan-3-yl)methanamine
CID 81473942

Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-[methylamino(oxolan-3-yl)methyl]pyridin-2-amine?
The IUPAC name of 4-methyl-3-[methylamino(oxolan-3-yl)methyl]pyridin-2-amine (CID 65329909) is 4-methyl-3-[methylamino(oxolan-3-yl)methyl]pyridin-2-amine.
What is the SMILES notation for 4-methyl-3-[methylamino(oxolan-3-yl)methyl]pyridin-2-amine?
The canonical SMILES for 4-methyl-3-[methylamino(oxolan-3-yl)methyl]pyridin-2-amine is CNC(c1c(C)ccnc1N)C1CCOC1.
What is the InChIKey of 4-methyl-3-[methylamino(oxolan-3-yl)methyl]pyridin-2-amine?
The InChIKey is ZYZOLZJGXDCFJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-8-3-5-15-12(13)10(8)11(14-2)9-4-6-16-7-9/h3,5,9,11,14H,4,6-7H2,1-2H3,(H2,13,15).
What are the key properties of 4-methyl-3-[methylamino(oxolan-3-yl)methyl]pyridin-2-amine?
4-methyl-3-[methylamino(oxolan-3-yl)methyl]pyridin-2-amine has a molecular weight of 221.30 g/mol, XLogP of 1.27, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-[methylamino(oxolan-3-yl)methyl]pyridin-2-amine is sourced from PubChem (CID 65329909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).