3-(difluoromethyl)-5-methoxypyridine-2,4-diamine

C7H9F2N3O — CID 119019295

IUPAC3-(difluoromethyl)-5-methoxypyridine-2,4-diamine
SMILESCOc1cnc(N)c(C(F)F)c1N
InChIInChI=1S/C7H9F2N3O/c1-13-3-2-12-7(11)4(5(3)10)6(8)9/h2,6H,1H3,(H4,10,11,12)
InChIKeyREZFBQTYOCTSMP-UHFFFAOYSA-N
MW189.17 g/mol
LogP1.19
Rot. Bonds2

About 3-(difluoromethyl)-5-methoxypyridine-2,4-diamine

3-(difluoromethyl)-5-methoxypyridine-2,4-diamine (PubChem CID 119019295) has the molecular formula C7H9F2N3O and a molecular weight of 189.17 g/mol. Its IUPAC name is 3-(difluoromethyl)-5-methoxypyridine-2,4-diamine.

Molecular Properties

Compound Name3-(difluoromethyl)-5-methoxypyridine-2,4-diamine
PubChem CID119019295
Molecular FormulaC7H9F2N3O
Molecular Weight189.17 g/mol
Exact Mass189.07
IUPAC Name3-(difluoromethyl)-5-methoxypyridine-2,4-diamine
SMILESCOc1cnc(N)c(C(F)F)c1N
InChIInChI=1S/C7H9F2N3O/c1-13-3-2-12-7(11)4(5(3)10)6(8)9/h2,6H,1H3,(H4,10,11,12)
InChIKeyREZFBQTYOCTSMP-UHFFFAOYSA-N
XLogP1.19
TPSA74.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.17
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(difluoromethyl)-2,5-dimethoxypyridin-4-amine
CID 130100785
4-(difluoromethyl)-3-fluoro-5-methoxypyridin-2-amine
CID 118991384
3-(difluoromethyl)-5-methoxy-2-(trifluoromethoxy)pyridin-4-amine
CID 118800001
4-amino-3-(difluoromethyl)-5-methoxypyridine-2-carbonyl chloride
CID 118812031
2-chloro-4-(difluoromethyl)-5-methoxypyridin-3-amine
CID 130102535
3-(difluoromethyl)-4-methoxy-5-(trifluoromethoxy)pyridin-2-amine
CID 119021668
4-amino-2-(difluoromethyl)-5-methoxypyridine-3-carbaldehyde
CID 118829242
3-(difluoromethyl)-4-methoxy-5-(trifluoromethyl)pyridin-2-amine
CID 119010486
[3-(difluoromethyl)-2-fluoro-5-methoxy-4-pyridinyl]methanamine
CID 118841033
2-(difluoromethyl)-4-fluoro-5-methoxypyridin-3-amine
CID 130103884
3-(difluoromethyl)-5-(trifluoromethyl)pyridine-2,4-diamine
CID 119006850
2,3-dibromo-4-(difluoromethyl)-5-methoxypyridine
CID 118992622

Frequently Asked Questions

What is the IUPAC name of 3-(difluoromethyl)-5-methoxypyridine-2,4-diamine?
The IUPAC name of 3-(difluoromethyl)-5-methoxypyridine-2,4-diamine (CID 119019295) is 3-(difluoromethyl)-5-methoxypyridine-2,4-diamine.
What is the SMILES notation for 3-(difluoromethyl)-5-methoxypyridine-2,4-diamine?
The canonical SMILES for 3-(difluoromethyl)-5-methoxypyridine-2,4-diamine is COc1cnc(N)c(C(F)F)c1N.
What is the InChIKey of 3-(difluoromethyl)-5-methoxypyridine-2,4-diamine?
The InChIKey is REZFBQTYOCTSMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9F2N3O/c1-13-3-2-12-7(11)4(5(3)10)6(8)9/h2,6H,1H3,(H4,10,11,12).
What are the key properties of 3-(difluoromethyl)-5-methoxypyridine-2,4-diamine?
3-(difluoromethyl)-5-methoxypyridine-2,4-diamine has a molecular weight of 189.17 g/mol, XLogP of 1.19, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(difluoromethyl)-5-methoxypyridine-2,4-diamine is sourced from PubChem (CID 119019295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).