6-N-(2,3-difluorophenyl)-2-N-propylpyridine-2,6-diamine

C14H15F2N3 — CID 80798545

IUPAC6-N-(2,3-difluorophenyl)-2-N-propylpyridine-2,6-diamine
SMILESCCCNc1cccc(Nc2cccc(F)c2F)n1
InChIInChI=1S/C14H15F2N3/c1-2-9-17-12-7-4-8-13(19-12)18-11-6-3-5-10(15)14(11)16/h3-8H,2,9H2,1H3,(H2,17,18,19)
InChIKeyYLRWQGVNVIXMEI-UHFFFAOYSA-N
MW263.29 g/mol
LogP3.93
Rot. Bonds5

About 6-N-(2,3-difluorophenyl)-2-N-propylpyridine-2,6-diamine

6-N-(2,3-difluorophenyl)-2-N-propylpyridine-2,6-diamine (PubChem CID 80798545) has the molecular formula C14H15F2N3 and a molecular weight of 263.29 g/mol. Its IUPAC name is 6-N-(2,3-difluorophenyl)-2-N-propylpyridine-2,6-diamine.

Molecular Properties

Compound Name6-N-(2,3-difluorophenyl)-2-N-propylpyridine-2,6-diamine
PubChem CID80798545
Molecular FormulaC14H15F2N3
Molecular Weight263.29 g/mol
Exact Mass263.12
IUPAC Name6-N-(2,3-difluorophenyl)-2-N-propylpyridine-2,6-diamine
SMILESCCCNc1cccc(Nc2cccc(F)c2F)n1
InChIInChI=1S/C14H15F2N3/c1-2-9-17-12-7-4-8-13(19-12)18-11-6-3-5-10(15)14(11)16/h3-8H,2,9H2,1H3,(H2,17,18,19)
InChIKeyYLRWQGVNVIXMEI-UHFFFAOYSA-N
XLogP3.93
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.29
LogP ≤ 53.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-N-(3-chloro-2-methylphenyl)-2-N-propylpyridine-2,6-diamine
CID 80762738
6-N-(2,3-dichlorophenyl)-2-N-propylpyridine-2,6-diamine
CID 80754904
2-N-ethyl-6-N-(3-fluoro-2-methylphenyl)pyridine-2,6-diamine
CID 80814736
6-N-(2-chloro-5-fluorophenyl)-2-N-propylpyridine-2,6-diamine
CID 107531766
6-N-(2-ethoxyphenyl)-2-N-propylpyridine-2,6-diamine
CID 80763066
N-(2-fluorophenyl)-6-(propylamino)pyridine-2-carboxamide
CID 62239443
4-N-(2,3-difluorophenyl)-6-N-ethylpyrimidine-2,4,6-triamine
CID 80797550
6-N-[1-(2-fluorophenyl)ethyl]-2-N-propylpyridine-2,6-diamine
CID 80802273
6-N-pentan-3-yl-2-N-propylpyridine-2,6-diamine
CID 80770551
6-N-[2-(4-fluorophenyl)ethyl]-2-N-propylpyridine-2,6-diamine
CID 80785034
4-N-(2,3-difluorophenyl)-2-propylpyrimidine-4,6-diamine
CID 80954438
N-(2,3-difluorophenyl)-6-(propylamino)pyridine-3-carboxamide
CID 62181665

Frequently Asked Questions

What is the IUPAC name of 6-N-(2,3-difluorophenyl)-2-N-propylpyridine-2,6-diamine?
The IUPAC name of 6-N-(2,3-difluorophenyl)-2-N-propylpyridine-2,6-diamine (CID 80798545) is 6-N-(2,3-difluorophenyl)-2-N-propylpyridine-2,6-diamine.
What is the SMILES notation for 6-N-(2,3-difluorophenyl)-2-N-propylpyridine-2,6-diamine?
The canonical SMILES for 6-N-(2,3-difluorophenyl)-2-N-propylpyridine-2,6-diamine is CCCNc1cccc(Nc2cccc(F)c2F)n1.
What is the InChIKey of 6-N-(2,3-difluorophenyl)-2-N-propylpyridine-2,6-diamine?
The InChIKey is YLRWQGVNVIXMEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15F2N3/c1-2-9-17-12-7-4-8-13(19-12)18-11-6-3-5-10(15)14(11)16/h3-8H,2,9H2,1H3,(H2,17,18,19).
What are the key properties of 6-N-(2,3-difluorophenyl)-2-N-propylpyridine-2,6-diamine?
6-N-(2,3-difluorophenyl)-2-N-propylpyridine-2,6-diamine has a molecular weight of 263.29 g/mol, XLogP of 3.93, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-(2,3-difluorophenyl)-2-N-propylpyridine-2,6-diamine is sourced from PubChem (CID 80798545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).