4-bromo-6-(difluoromethyl)-5-methoxypyridin-3-amine

C7H7BrF2N2O — CID 130101766

IUPAC4-bromo-6-(difluoromethyl)-5-methoxypyridin-3-amine
SMILESCOc1c(C(F)F)ncc(N)c1Br
InChIInChI=1S/C7H7BrF2N2O/c1-13-6-4(8)3(11)2-12-5(6)7(9)10/h2,7H,11H2,1H3
InChIKeyYHYOKFDNAVUOFP-UHFFFAOYSA-N
MW253.05 g/mol
LogP2.37
Rot. Bonds2

About 4-bromo-6-(difluoromethyl)-5-methoxypyridin-3-amine

4-bromo-6-(difluoromethyl)-5-methoxypyridin-3-amine (PubChem CID 130101766) has the molecular formula C7H7BrF2N2O and a molecular weight of 253.05 g/mol. Its IUPAC name is 4-bromo-6-(difluoromethyl)-5-methoxypyridin-3-amine.

Molecular Properties

Compound Name4-bromo-6-(difluoromethyl)-5-methoxypyridin-3-amine
PubChem CID130101766
Molecular FormulaC7H7BrF2N2O
Molecular Weight253.05 g/mol
Exact Mass251.97
IUPAC Name4-bromo-6-(difluoromethyl)-5-methoxypyridin-3-amine
SMILESCOc1c(C(F)F)ncc(N)c1Br
InChIInChI=1S/C7H7BrF2N2O/c1-13-6-4(8)3(11)2-12-5(6)7(9)10/h2,7H,11H2,1H3
InChIKeyYHYOKFDNAVUOFP-UHFFFAOYSA-N
XLogP2.37
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.05
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-bromo-6-(difluoromethyl)-5-methoxy-3-pyridinyl]acetic acid
CID 118805918
6-bromo-5-(difluoromethyl)-4-methoxypyridin-3-amine
CID 130101775
ethyl 2-[5-bromo-6-(difluoromethyl)-4-methoxy-3-pyridinyl]acetate
CID 134684413
2-[5-amino-2-(difluoromethyl)-3-methoxy-4-pyridinyl]acetonitrile
CID 130106062
ethyl 2-[5-amino-3-bromo-2-(difluoromethyl)-4-pyridinyl]acetate
CID 134669258
ethyl 2-[5-amino-2-(difluoromethyl)-4-methoxy-3-pyridinyl]acetate
CID 134683817
2-[5-bromo-6-(difluoromethyl)-4-methoxy-3-pyridinyl]acetonitrile
CID 130068862
4-amino-6-(difluoromethyl)-5-methoxypyridine-3-carbaldehyde
CID 118851864
4-amino-6-(difluoromethyl)-5-methoxypyridine-3-carbonyl chloride
CID 118829154
5-bromo-2-(difluoromethyl)-3-methoxypyridine-4-sulfonyl chloride
CID 130069032
2-bromo-5-(difluoromethyl)-3-methoxypyridin-4-amine
CID 130101773
2-(difluoromethyl)-5-fluoro-3-methoxypyridine-4-sulfonamide
CID 118820670

Frequently Asked Questions

What is the IUPAC name of 4-bromo-6-(difluoromethyl)-5-methoxypyridin-3-amine?
The IUPAC name of 4-bromo-6-(difluoromethyl)-5-methoxypyridin-3-amine (CID 130101766) is 4-bromo-6-(difluoromethyl)-5-methoxypyridin-3-amine.
What is the SMILES notation for 4-bromo-6-(difluoromethyl)-5-methoxypyridin-3-amine?
The canonical SMILES for 4-bromo-6-(difluoromethyl)-5-methoxypyridin-3-amine is COc1c(C(F)F)ncc(N)c1Br.
What is the InChIKey of 4-bromo-6-(difluoromethyl)-5-methoxypyridin-3-amine?
The InChIKey is YHYOKFDNAVUOFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7BrF2N2O/c1-13-6-4(8)3(11)2-12-5(6)7(9)10/h2,7H,11H2,1H3.
What are the key properties of 4-bromo-6-(difluoromethyl)-5-methoxypyridin-3-amine?
4-bromo-6-(difluoromethyl)-5-methoxypyridin-3-amine has a molecular weight of 253.05 g/mol, XLogP of 2.37, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-6-(difluoromethyl)-5-methoxypyridin-3-amine is sourced from PubChem (CID 130101766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).