2-N-(3-methoxypropyl)-2-N,5-dimethylpyridine-2,3-diamine

C11H19N3O — CID 66279324

IUPAC2-N-(3-methoxypropyl)-2-N,5-dimethylpyridine-2,3-diamine
SMILESCOCCCN(C)c1ncc(C)cc1N
InChIInChI=1S/C11H19N3O/c1-9-7-10(12)11(13-8-9)14(2)5-4-6-15-3/h7-8H,4-6,12H2,1-3H3
InChIKeyTZJUXTRYSGPFIO-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.44
Rot. Bonds5

About 2-N-(3-methoxypropyl)-2-N,5-dimethylpyridine-2,3-diamine

2-N-(3-methoxypropyl)-2-N,5-dimethylpyridine-2,3-diamine (PubChem CID 66279324) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 2-N-(3-methoxypropyl)-2-N,5-dimethylpyridine-2,3-diamine.

Molecular Properties

Compound Name2-N-(3-methoxypropyl)-2-N,5-dimethylpyridine-2,3-diamine
PubChem CID66279324
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name2-N-(3-methoxypropyl)-2-N,5-dimethylpyridine-2,3-diamine
SMILESCOCCCN(C)c1ncc(C)cc1N
InChIInChI=1S/C11H19N3O/c1-9-7-10(12)11(13-8-9)14(2)5-4-6-15-3/h7-8H,4-6,12H2,1-3H3
InChIKeyTZJUXTRYSGPFIO-UHFFFAOYSA-N
XLogP1.44
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

5-bromo-2-N-(3-methoxypropyl)-2-N-methylpyridine-2,3-diamine
CID 59631539
2-N-butyl-2-N,5-dimethylpyridine-2,3-diamine
CID 66279285
3-bromo-2-N-(3-methoxypropyl)-2-N,4-dimethylpyridine-2,5-diamine
CID 104506805
2-N-[(4-methoxyphenyl)methyl]-2-N,5-dimethylpyridine-2,3-diamine
CID 66277992
5-bromo-3-fluoro-N-(3-methoxypropyl)-N-methylpyridin-2-amine
CID 104918962
N-(3-methoxypropyl)-N,3-dimethyl-5-(methylaminomethyl)pyridin-2-amine
CID 80636357
2-N-(2-ethoxyethyl)-2-N-ethyl-5-methylpyridine-2,3-diamine
CID 66280209
5-chloro-2-hydrazinyl-N-(3-methoxypropyl)-N-methylpyrimidin-4-amine
CID 80913814
2-N-[2-[2-methoxyethyl(methyl)amino]ethyl]-5-methylpyridine-2,3-diamine
CID 66281077
3-N-(3-methoxypropyl)-3-N,2-dimethylbenzene-1,3-diamine
CID 63062749
1-N-(3-methoxypropyl)-1-N,2-dimethylbenzene-1,4-diamine
CID 62985550
2-N-ethyl-5-methyl-2-N-propylpyridine-2,3-diamine
CID 66278862

Frequently Asked Questions

What is the IUPAC name of 2-N-(3-methoxypropyl)-2-N,5-dimethylpyridine-2,3-diamine?
The IUPAC name of 2-N-(3-methoxypropyl)-2-N,5-dimethylpyridine-2,3-diamine (CID 66279324) is 2-N-(3-methoxypropyl)-2-N,5-dimethylpyridine-2,3-diamine.
What is the SMILES notation for 2-N-(3-methoxypropyl)-2-N,5-dimethylpyridine-2,3-diamine?
The canonical SMILES for 2-N-(3-methoxypropyl)-2-N,5-dimethylpyridine-2,3-diamine is COCCCN(C)c1ncc(C)cc1N.
What is the InChIKey of 2-N-(3-methoxypropyl)-2-N,5-dimethylpyridine-2,3-diamine?
The InChIKey is TZJUXTRYSGPFIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-9-7-10(12)11(13-8-9)14(2)5-4-6-15-3/h7-8H,4-6,12H2,1-3H3.
What are the key properties of 2-N-(3-methoxypropyl)-2-N,5-dimethylpyridine-2,3-diamine?
2-N-(3-methoxypropyl)-2-N,5-dimethylpyridine-2,3-diamine has a molecular weight of 209.29 g/mol, XLogP of 1.44, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(3-methoxypropyl)-2-N,5-dimethylpyridine-2,3-diamine is sourced from PubChem (CID 66279324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).