N',N'-bis(2-methoxyethyl)-N-pyridin-3-ylethane-1,2-diamine

C13H23N3O2 — CID 67897474

IUPACN',N'-bis(2-methoxyethyl)-N-pyridin-3-ylethane-1,2-diamine
SMILESCOCCN(CCNc1cccnc1)CCOC
InChIInChI=1S/C13H23N3O2/c1-17-10-8-16(9-11-18-2)7-6-15-13-4-3-5-14-12-13/h3-5,12,15H,6-11H2,1-2H3
InChIKeyFODHNDALDNQTOM-UHFFFAOYSA-N
MW253.35 g/mol
LogP1.09
Rot. Bonds10

About N',N'-bis(2-methoxyethyl)-N-pyridin-3-ylethane-1,2-diamine

N',N'-bis(2-methoxyethyl)-N-pyridin-3-ylethane-1,2-diamine (PubChem CID 67897474) has the molecular formula C13H23N3O2 and a molecular weight of 253.35 g/mol. Its IUPAC name is N',N'-bis(2-methoxyethyl)-N-pyridin-3-ylethane-1,2-diamine.

Molecular Properties

Compound NameN',N'-bis(2-methoxyethyl)-N-pyridin-3-ylethane-1,2-diamine
PubChem CID67897474
Molecular FormulaC13H23N3O2
Molecular Weight253.35 g/mol
Exact Mass253.18
IUPAC NameN',N'-bis(2-methoxyethyl)-N-pyridin-3-ylethane-1,2-diamine
SMILESCOCCN(CCNc1cccnc1)CCOC
InChIInChI=1S/C13H23N3O2/c1-17-10-8-16(9-11-18-2)7-6-15-13-4-3-5-14-12-13/h3-5,12,15H,6-11H2,1-2H3
InChIKeyFODHNDALDNQTOM-UHFFFAOYSA-N
XLogP1.09
TPSA46.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-fluorophenyl)-N',N'-bis(2-methoxyethyl)ethane-1,2-diamine
CID 55089867
N'-(2-methoxyethyl)-N'-(3-methoxypropyl)-N-(3-methylphenyl)ethane-1,2-diamine
CID 62555115
N-methyl-N'-pyridin-3-ylmethanediamine
CID 115226589
N'-(2-methoxyethyl)-N'-methyl-N-pyridin-4-ylethane-1,2-diamine
CID 62844188
2-N-(2-methoxyethyl)-2-N-methyl-1-N-pyridin-3-ylbenzene-1,2-disulfonamide
CID 122152668
2-(pyridin-3-ylamino)acetonitrile
CID 24972763
N-(3-bromophenyl)-N'-(2-methoxyethyl)-N'-(2-methylpropyl)ethane-1,2-diamine
CID 62556159
4-N,4-N-bis(2-methoxyethyl)-6-N-pyridin-3-ylpyrimidine-4,5,6-triamine
CID 19141594
N'-(2-methoxyethyl)-N'-methyl-N-(2-pyridin-3-ylethyl)ethane-1,2-diamine
CID 63264515
2-methoxy-N-(2-methoxyethyl)-N-[(2-pyridin-3-yloxyphenyl)methyl]ethanamine
CID 141198756
ethane;N-methylpyridin-3-amine
CID 91430147
3-N-(2-methoxyethyl)-3-N-methyl-1-N-pyridin-3-ylbenzene-1,3-disulfonamide
CID 122152661

Frequently Asked Questions

What is the IUPAC name of N',N'-bis(2-methoxyethyl)-N-pyridin-3-ylethane-1,2-diamine?
The IUPAC name of N',N'-bis(2-methoxyethyl)-N-pyridin-3-ylethane-1,2-diamine (CID 67897474) is N',N'-bis(2-methoxyethyl)-N-pyridin-3-ylethane-1,2-diamine.
What is the SMILES notation for N',N'-bis(2-methoxyethyl)-N-pyridin-3-ylethane-1,2-diamine?
The canonical SMILES for N',N'-bis(2-methoxyethyl)-N-pyridin-3-ylethane-1,2-diamine is COCCN(CCNc1cccnc1)CCOC.
What is the InChIKey of N',N'-bis(2-methoxyethyl)-N-pyridin-3-ylethane-1,2-diamine?
The InChIKey is FODHNDALDNQTOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O2/c1-17-10-8-16(9-11-18-2)7-6-15-13-4-3-5-14-12-13/h3-5,12,15H,6-11H2,1-2H3.
What are the key properties of N',N'-bis(2-methoxyethyl)-N-pyridin-3-ylethane-1,2-diamine?
N',N'-bis(2-methoxyethyl)-N-pyridin-3-ylethane-1,2-diamine has a molecular weight of 253.35 g/mol, XLogP of 1.09, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-bis(2-methoxyethyl)-N-pyridin-3-ylethane-1,2-diamine is sourced from PubChem (CID 67897474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).