3,5-dichloro-2-N-propyl-6-N-(1-pyridin-2-ylethyl)pyridine-2,6-diamine

C15H18Cl2N4 — CID 102756051

IUPAC3,5-dichloro-2-N-propyl-6-N-(1-pyridin-2-ylethyl)pyridine-2,6-diamine
SMILESCCCNc1nc(NC(C)c2ccccn2)c(Cl)cc1Cl
InChIInChI=1S/C15H18Cl2N4/c1-3-7-19-14-11(16)9-12(17)15(21-14)20-10(2)13-6-4-5-8-18-13/h4-6,8-10H,3,7H2,1-2H3,(H2,19,20,21)
InChIKeyUBHQWIDUBRYHLQ-UHFFFAOYSA-N
MW325.24 g/mol
LogP4.78
Rot. Bonds6

About 3,5-dichloro-2-N-propyl-6-N-(1-pyridin-2-ylethyl)pyridine-2,6-diamine

3,5-dichloro-2-N-propyl-6-N-(1-pyridin-2-ylethyl)pyridine-2,6-diamine (PubChem CID 102756051) has the molecular formula C15H18Cl2N4 and a molecular weight of 325.24 g/mol. Its IUPAC name is 3,5-dichloro-2-N-propyl-6-N-(1-pyridin-2-ylethyl)pyridine-2,6-diamine.

Molecular Properties

Compound Name3,5-dichloro-2-N-propyl-6-N-(1-pyridin-2-ylethyl)pyridine-2,6-diamine
PubChem CID102756051
Molecular FormulaC15H18Cl2N4
Molecular Weight325.24 g/mol
Exact Mass324.09
IUPAC Name3,5-dichloro-2-N-propyl-6-N-(1-pyridin-2-ylethyl)pyridine-2,6-diamine
SMILESCCCNc1nc(NC(C)c2ccccn2)c(Cl)cc1Cl
InChIInChI=1S/C15H18Cl2N4/c1-3-7-19-14-11(16)9-12(17)15(21-14)20-10(2)13-6-4-5-8-18-13/h4-6,8-10H,3,7H2,1-2H3,(H2,19,20,21)
InChIKeyUBHQWIDUBRYHLQ-UHFFFAOYSA-N
XLogP4.78
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.24
LogP ≤ 54.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-N-propyl-2-N-(1-pyridin-2-ylethyl)pyrazine-2,6-diamine
CID 80781351
3,5-dichloro-6-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-2-N-propylpyridine-2,6-diamine
CID 106390393
3-[[3,5-dichloro-6-(propylamino)-2-pyridinyl]amino]-2-methylbutan-1-ol
CID 102759896
3,5-dichloro-6-N-(1-cyclopentylethyl)-2-N-propylpyridine-2,6-diamine
CID 102758469
3,5-dichloro-2-N-ethyl-6-N-(2-pyridin-2-ylethyl)pyridine-2,6-diamine
CID 102755416
3,5-dichloro-6-N-(3-fluoropropyl)-2-N-propylpyridine-2,6-diamine
CID 114267273
3-chloro-4-ethoxy-N-(1-pyridin-2-ylethyl)aniline
CID 54863996
5-bromo-2-chloro-N-(1-pyridin-2-ylethyl)pyrimidin-4-amine
CID 79075980
3,5-dichloro-2-N-propyl-6-N-(pyridazin-3-ylmethyl)pyridine-2,6-diamine
CID 106898227
4-chloro-N-(1-pyridin-2-ylethyl)aniline
CID 43194293
3-chloro-4-fluoro-N-(1-pyridin-2-ylethyl)aniline
CID 43119234
5-[[3,5-dichloro-6-(propylamino)-2-pyridinyl]amino]-2-methylpentan-1-ol
CID 106163265

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-2-N-propyl-6-N-(1-pyridin-2-ylethyl)pyridine-2,6-diamine?
The IUPAC name of 3,5-dichloro-2-N-propyl-6-N-(1-pyridin-2-ylethyl)pyridine-2,6-diamine (CID 102756051) is 3,5-dichloro-2-N-propyl-6-N-(1-pyridin-2-ylethyl)pyridine-2,6-diamine.
What is the SMILES notation for 3,5-dichloro-2-N-propyl-6-N-(1-pyridin-2-ylethyl)pyridine-2,6-diamine?
The canonical SMILES for 3,5-dichloro-2-N-propyl-6-N-(1-pyridin-2-ylethyl)pyridine-2,6-diamine is CCCNc1nc(NC(C)c2ccccn2)c(Cl)cc1Cl.
What is the InChIKey of 3,5-dichloro-2-N-propyl-6-N-(1-pyridin-2-ylethyl)pyridine-2,6-diamine?
The InChIKey is UBHQWIDUBRYHLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18Cl2N4/c1-3-7-19-14-11(16)9-12(17)15(21-14)20-10(2)13-6-4-5-8-18-13/h4-6,8-10H,3,7H2,1-2H3,(H2,19,20,21).
What are the key properties of 3,5-dichloro-2-N-propyl-6-N-(1-pyridin-2-ylethyl)pyridine-2,6-diamine?
3,5-dichloro-2-N-propyl-6-N-(1-pyridin-2-ylethyl)pyridine-2,6-diamine has a molecular weight of 325.24 g/mol, XLogP of 4.78, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-2-N-propyl-6-N-(1-pyridin-2-ylethyl)pyridine-2,6-diamine is sourced from PubChem (CID 102756051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).