2-chloro-4-(difluoromethyl)-5-methoxypyridin-3-amine

C7H7ClF2N2O — CID 130102535

IUPAC2-chloro-4-(difluoromethyl)-5-methoxypyridin-3-amine
SMILESCOc1cnc(Cl)c(N)c1C(F)F
InChIInChI=1S/C7H7ClF2N2O/c1-13-3-2-12-6(8)5(11)4(3)7(9)10/h2,7H,11H2,1H3
InChIKeyAXXUJPIBDGLWGZ-UHFFFAOYSA-N
MW208.60 g/mol
LogP2.26
Rot. Bonds2

About 2-chloro-4-(difluoromethyl)-5-methoxypyridin-3-amine

2-chloro-4-(difluoromethyl)-5-methoxypyridin-3-amine (PubChem CID 130102535) has the molecular formula C7H7ClF2N2O and a molecular weight of 208.60 g/mol. Its IUPAC name is 2-chloro-4-(difluoromethyl)-5-methoxypyridin-3-amine.

Molecular Properties

Compound Name2-chloro-4-(difluoromethyl)-5-methoxypyridin-3-amine
PubChem CID130102535
Molecular FormulaC7H7ClF2N2O
Molecular Weight208.60 g/mol
Exact Mass208.02
IUPAC Name2-chloro-4-(difluoromethyl)-5-methoxypyridin-3-amine
SMILESCOc1cnc(Cl)c(N)c1C(F)F
InChIInChI=1S/C7H7ClF2N2O/c1-13-3-2-12-6(8)5(11)4(3)7(9)10/h2,7H,11H2,1H3
InChIKeyAXXUJPIBDGLWGZ-UHFFFAOYSA-N
XLogP2.26
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.60
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2-chloro-3-(difluoromethyl)-4-fluoro-5-methoxypyridine
CID 119010666
3-(difluoromethyl)-5-methoxypyridine-2,4-diamine
CID 119019295
4-(difluoromethyl)-3-fluoro-5-methoxypyridin-2-amine
CID 118991384
3-(difluoromethyl)-2,5-dimethoxypyridin-4-amine
CID 130100785
2-chloro-3-fluoro-5-methoxypyridin-4-amine
CID 141356822
4-amino-3-(difluoromethyl)-5-methoxypyridine-2-carbonyl chloride
CID 118812031
2-chloro-3-(difluoromethyl)-5-(trifluoromethoxy)pyridin-4-amine
CID 118811897
6-chloro-5-(difluoromethyl)-4-methoxypyridin-2-amine
CID 130102534
2,3-dibromo-4-(difluoromethyl)-5-methoxypyridine
CID 118992622
4-(difluoromethyl)-3-fluoro-5-methoxypyridine-2-carboxamide
CID 118852090
3-(difluoromethyl)-5-methoxy-2-(trifluoromethoxy)pyridin-4-amine
CID 118800001
ethyl 2-[5-amino-6-chloro-4-(difluoromethyl)-3-pyridinyl]acetate
CID 134669265

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-(difluoromethyl)-5-methoxypyridin-3-amine?
The IUPAC name of 2-chloro-4-(difluoromethyl)-5-methoxypyridin-3-amine (CID 130102535) is 2-chloro-4-(difluoromethyl)-5-methoxypyridin-3-amine.
What is the SMILES notation for 2-chloro-4-(difluoromethyl)-5-methoxypyridin-3-amine?
The canonical SMILES for 2-chloro-4-(difluoromethyl)-5-methoxypyridin-3-amine is COc1cnc(Cl)c(N)c1C(F)F.
What is the InChIKey of 2-chloro-4-(difluoromethyl)-5-methoxypyridin-3-amine?
The InChIKey is AXXUJPIBDGLWGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7ClF2N2O/c1-13-3-2-12-6(8)5(11)4(3)7(9)10/h2,7H,11H2,1H3.
What are the key properties of 2-chloro-4-(difluoromethyl)-5-methoxypyridin-3-amine?
2-chloro-4-(difluoromethyl)-5-methoxypyridin-3-amine has a molecular weight of 208.60 g/mol, XLogP of 2.26, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-(difluoromethyl)-5-methoxypyridin-3-amine is sourced from PubChem (CID 130102535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).