5-N,5-N-bis(2-methoxyethyl)-3-N-methylpyridine-3,5-diamine

C12H21N3O2 — CID 113423780

IUPAC5-N,5-N-bis(2-methoxyethyl)-3-N-methylpyridine-3,5-diamine
SMILESCNc1cncc(N(CCOC)CCOC)c1
InChIInChI=1S/C12H21N3O2/c1-13-11-8-12(10-14-9-11)15(4-6-16-2)5-7-17-3/h8-10,13H,4-7H2,1-3H3
InChIKeyWHRURSMZDZJQBI-UHFFFAOYSA-N
MW239.32 g/mol
LogP1.22
Rot. Bonds8

About 5-N,5-N-bis(2-methoxyethyl)-3-N-methylpyridine-3,5-diamine

5-N,5-N-bis(2-methoxyethyl)-3-N-methylpyridine-3,5-diamine (PubChem CID 113423780) has the molecular formula C12H21N3O2 and a molecular weight of 239.32 g/mol. Its IUPAC name is 5-N,5-N-bis(2-methoxyethyl)-3-N-methylpyridine-3,5-diamine.

Molecular Properties

Compound Name5-N,5-N-bis(2-methoxyethyl)-3-N-methylpyridine-3,5-diamine
PubChem CID113423780
Molecular FormulaC12H21N3O2
Molecular Weight239.32 g/mol
Exact Mass239.16
IUPAC Name5-N,5-N-bis(2-methoxyethyl)-3-N-methylpyridine-3,5-diamine
SMILESCNc1cncc(N(CCOC)CCOC)c1
InChIInChI=1S/C12H21N3O2/c1-13-11-8-12(10-14-9-11)15(4-6-16-2)5-7-17-3/h8-10,13H,4-7H2,1-3H3
InChIKeyWHRURSMZDZJQBI-UHFFFAOYSA-N
XLogP1.22
TPSA46.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-N-methyl-5-N,5-N-dipropylpyridine-3,5-diamine
CID 104532476
2-[2-hydroxyethyl-[5-(methylamino)-3-pyridinyl]amino]ethanol
CID 104533210
5-N-(2-methoxyethyl)-5-N-(1-methoxypropan-2-yl)-3-N-methylpyridine-3,5-diamine
CID 104533784
5-[3-(2-methoxyethoxy)propoxy]-N-methylpyridin-3-amine
CID 103408503
2-N-(2-methoxyethyl)-2-N-(3-methoxypropyl)-6-N-methylpyrazine-2,6-diamine
CID 80806190
5-[2-(dimethylamino)ethoxy]-N-methylpyridin-3-amine
CID 104536648
5-N-ethyl-3-N-methyl-5-N-(2,2,2-trifluoroethyl)pyridine-3,5-diamine
CID 104533826
5-N-(2-methoxyethyl)-5-N-propan-2-yl-3-N-propylpyridine-3,5-diamine
CID 113424214
5-(1-methoxypropan-2-yloxy)-N-methylpyridin-3-amine
CID 104536802
3-N,5-N,5-N-tripropylpyridine-3,5-diamine
CID 104532474
5-N-(1-methoxypentan-2-yl)-3-N-methylpyridine-3,5-diamine
CID 104534857
ethane;5-methoxy-N-methylpyridin-3-amine
CID 168998921

Frequently Asked Questions

What is the IUPAC name of 5-N,5-N-bis(2-methoxyethyl)-3-N-methylpyridine-3,5-diamine?
The IUPAC name of 5-N,5-N-bis(2-methoxyethyl)-3-N-methylpyridine-3,5-diamine (CID 113423780) is 5-N,5-N-bis(2-methoxyethyl)-3-N-methylpyridine-3,5-diamine.
What is the SMILES notation for 5-N,5-N-bis(2-methoxyethyl)-3-N-methylpyridine-3,5-diamine?
The canonical SMILES for 5-N,5-N-bis(2-methoxyethyl)-3-N-methylpyridine-3,5-diamine is CNc1cncc(N(CCOC)CCOC)c1.
What is the InChIKey of 5-N,5-N-bis(2-methoxyethyl)-3-N-methylpyridine-3,5-diamine?
The InChIKey is WHRURSMZDZJQBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O2/c1-13-11-8-12(10-14-9-11)15(4-6-16-2)5-7-17-3/h8-10,13H,4-7H2,1-3H3.
What are the key properties of 5-N,5-N-bis(2-methoxyethyl)-3-N-methylpyridine-3,5-diamine?
5-N,5-N-bis(2-methoxyethyl)-3-N-methylpyridine-3,5-diamine has a molecular weight of 239.32 g/mol, XLogP of 1.22, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N,5-N-bis(2-methoxyethyl)-3-N-methylpyridine-3,5-diamine is sourced from PubChem (CID 113423780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).