6-propoxy-2-N-(2-pyridin-3-ylethyl)pyridine-2,5-diamine

C15H20N4O — CID 60895722

IUPAC6-propoxy-2-N-(2-pyridin-3-ylethyl)pyridine-2,5-diamine
SMILESCCCOc1nc(NCCc2cccnc2)ccc1N
InChIInChI=1S/C15H20N4O/c1-2-10-20-15-13(16)5-6-14(19-15)18-9-7-12-4-3-8-17-11-12/h3-6,8,11H,2,7,9-10,16H2,1H3,(H,18,19)
InChIKeyJDIYMFMWHYGTDE-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.50
Rot. Bonds7

About 6-propoxy-2-N-(2-pyridin-3-ylethyl)pyridine-2,5-diamine

6-propoxy-2-N-(2-pyridin-3-ylethyl)pyridine-2,5-diamine (PubChem CID 60895722) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 6-propoxy-2-N-(2-pyridin-3-ylethyl)pyridine-2,5-diamine.

Molecular Properties

Compound Name6-propoxy-2-N-(2-pyridin-3-ylethyl)pyridine-2,5-diamine
PubChem CID60895722
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name6-propoxy-2-N-(2-pyridin-3-ylethyl)pyridine-2,5-diamine
SMILESCCCOc1nc(NCCc2cccnc2)ccc1N
InChIInChI=1S/C15H20N4O/c1-2-10-20-15-13(16)5-6-14(19-15)18-9-7-12-4-3-8-17-11-12/h3-6,8,11H,2,7,9-10,16H2,1H3,(H,18,19)
InChIKeyJDIYMFMWHYGTDE-UHFFFAOYSA-N
XLogP2.50
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-ethoxy-2-N-(2-pyridin-3-ylethyl)pyridine-2,5-diamine
CID 60896057
6-propoxy-2-N-(pyridin-3-ylmethyl)pyridine-2,5-diamine
CID 43261223
6-propoxy-2-N-(2-thiophen-3-ylethyl)pyridine-2,5-diamine
CID 61474843
4-N-(2-pyridin-3-ylethyl)pyrimidine-2,4-diamine
CID 80791275
2-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-6-propoxypyridine-2,5-diamine
CID 106393782
2-N-[3-(dimethylamino)propyl]-6-propoxypyridine-2,5-diamine
CID 43261174
5-methoxy-N-(2-pyridin-3-ylethyl)pyridin-2-amine
CID 106503992
2-N-[3-(diethylamino)propyl]-6-propoxypyridine-2,5-diamine
CID 43261118
6-N-ethyl-2-N-(2-pyridin-3-ylethyl)pyrazine-2,6-diamine
CID 78990149
2-[2-[(5-amino-6-propoxy-2-pyridinyl)amino]ethoxy]acetamide
CID 106234525
2-N-(2-but-3-enoxyethyl)-6-propoxypyridine-2,5-diamine
CID 106394409
4-N-(2-pyridin-3-ylethyl)pyrimidine-2,4,6-triamine
CID 80791747

Frequently Asked Questions

What is the IUPAC name of 6-propoxy-2-N-(2-pyridin-3-ylethyl)pyridine-2,5-diamine?
The IUPAC name of 6-propoxy-2-N-(2-pyridin-3-ylethyl)pyridine-2,5-diamine (CID 60895722) is 6-propoxy-2-N-(2-pyridin-3-ylethyl)pyridine-2,5-diamine.
What is the SMILES notation for 6-propoxy-2-N-(2-pyridin-3-ylethyl)pyridine-2,5-diamine?
The canonical SMILES for 6-propoxy-2-N-(2-pyridin-3-ylethyl)pyridine-2,5-diamine is CCCOc1nc(NCCc2cccnc2)ccc1N.
What is the InChIKey of 6-propoxy-2-N-(2-pyridin-3-ylethyl)pyridine-2,5-diamine?
The InChIKey is JDIYMFMWHYGTDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-2-10-20-15-13(16)5-6-14(19-15)18-9-7-12-4-3-8-17-11-12/h3-6,8,11H,2,7,9-10,16H2,1H3,(H,18,19).
What are the key properties of 6-propoxy-2-N-(2-pyridin-3-ylethyl)pyridine-2,5-diamine?
6-propoxy-2-N-(2-pyridin-3-ylethyl)pyridine-2,5-diamine has a molecular weight of 272.35 g/mol, XLogP of 2.50, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-propoxy-2-N-(2-pyridin-3-ylethyl)pyridine-2,5-diamine is sourced from PubChem (CID 60895722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).