N-(2-methoxyethyl)-5-(methylaminomethyl)-N-prop-2-enylpyridin-2-amine

C13H21N3O — CID 103340163

IUPACN-(2-methoxyethyl)-5-(methylaminomethyl)-N-prop-2-enylpyridin-2-amine
SMILESC=CCN(CCOC)c1ccc(CNC)cn1
InChIInChI=1S/C13H21N3O/c1-4-7-16(8-9-17-3)13-6-5-12(10-14-2)11-15-13/h4-6,11,14H,1,7-10H2,2-3H3
InChIKeyHQVHVJATLYGPSI-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.44
Rot. Bonds8

About N-(2-methoxyethyl)-5-(methylaminomethyl)-N-prop-2-enylpyridin-2-amine

N-(2-methoxyethyl)-5-(methylaminomethyl)-N-prop-2-enylpyridin-2-amine (PubChem CID 103340163) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is N-(2-methoxyethyl)-5-(methylaminomethyl)-N-prop-2-enylpyridin-2-amine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-5-(methylaminomethyl)-N-prop-2-enylpyridin-2-amine
PubChem CID103340163
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC NameN-(2-methoxyethyl)-5-(methylaminomethyl)-N-prop-2-enylpyridin-2-amine
SMILESC=CCN(CCOC)c1ccc(CNC)cn1
InChIInChI=1S/C13H21N3O/c1-4-7-16(8-9-17-3)13-6-5-12(10-14-2)11-15-13/h4-6,11,14H,1,7-10H2,2-3H3
InChIKeyHQVHVJATLYGPSI-UHFFFAOYSA-N
XLogP1.44
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-Amino-3-methylpyridine
CID 15347
2-Amino-5-methylpyridine
CID 15348
2-(Benzylamino)pyridine
CID 23362
2-Pyridinamine, 4-methyl-N-(phenylmethyl)-
CID 83053
N-cyclohexyl-4-methylpyridin-2-amine
CID 2366458
Ethyl 4-[(4-methylpyridin-2-yl)amino]piperidine-1-carboxylate
CID 11149707
N1,N1-Dimethyl-N2-2-pyridinyl-1,2-ethanediamine
CID 90273
6-Morpholinonicotinonitrile
CID 2737021
(3-Methyl-pyridin-2-yl)-thiourea
CID 1480047
2-(Morpholin-4-yl)pyridine-3-carbonitrile
CID 2763852
2-Acetamido-3-methylpyridine
CID 268295
2-Allylaminopyridine
CID 260916

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-5-(methylaminomethyl)-N-prop-2-enylpyridin-2-amine?
The IUPAC name of N-(2-methoxyethyl)-5-(methylaminomethyl)-N-prop-2-enylpyridin-2-amine (CID 103340163) is N-(2-methoxyethyl)-5-(methylaminomethyl)-N-prop-2-enylpyridin-2-amine.
What is the SMILES notation for N-(2-methoxyethyl)-5-(methylaminomethyl)-N-prop-2-enylpyridin-2-amine?
The canonical SMILES for N-(2-methoxyethyl)-5-(methylaminomethyl)-N-prop-2-enylpyridin-2-amine is C=CCN(CCOC)c1ccc(CNC)cn1.
What is the InChIKey of N-(2-methoxyethyl)-5-(methylaminomethyl)-N-prop-2-enylpyridin-2-amine?
The InChIKey is HQVHVJATLYGPSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-4-7-16(8-9-17-3)13-6-5-12(10-14-2)11-15-13/h4-6,11,14H,1,7-10H2,2-3H3.
What are the key properties of N-(2-methoxyethyl)-5-(methylaminomethyl)-N-prop-2-enylpyridin-2-amine?
N-(2-methoxyethyl)-5-(methylaminomethyl)-N-prop-2-enylpyridin-2-amine has a molecular weight of 235.33 g/mol, XLogP of 1.44, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-5-(methylaminomethyl)-N-prop-2-enylpyridin-2-amine is sourced from PubChem (CID 103340163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).