6-(aminomethyl)-5-chloro-4-(difluoromethyl)pyridin-3-ol

C7H7ClF2N2O — CID 118825681

IUPAC6-(aminomethyl)-5-chloro-4-(difluoromethyl)pyridin-3-ol
SMILESNCc1ncc(O)c(C(F)F)c1Cl
InChIInChI=1S/C7H7ClF2N2O/c8-6-3(1-11)12-2-4(13)5(6)7(9)10/h2,7,13H,1,11H2
InChIKeyXCCSYXMCNLVBNF-UHFFFAOYSA-N
MW208.59 g/mol
LogP1.84
Rot. Bonds2

About 6-(aminomethyl)-5-chloro-4-(difluoromethyl)pyridin-3-ol

6-(aminomethyl)-5-chloro-4-(difluoromethyl)pyridin-3-ol (PubChem CID 118825681) has the molecular formula C7H7ClF2N2O and a molecular weight of 208.59 g/mol. Its IUPAC name is 6-(aminomethyl)-5-chloro-4-(difluoromethyl)pyridin-3-ol.

Molecular Properties

Compound Name6-(aminomethyl)-5-chloro-4-(difluoromethyl)pyridin-3-ol
PubChem CID118825681
Molecular FormulaC7H7ClF2N2O
Molecular Weight208.59 g/mol
Exact Mass208.02
IUPAC Name6-(aminomethyl)-5-chloro-4-(difluoromethyl)pyridin-3-ol
SMILESNCc1ncc(O)c(C(F)F)c1Cl
InChIInChI=1S/C7H7ClF2N2O/c8-6-3(1-11)12-2-4(13)5(6)7(9)10/h2,7,13H,1,11H2
InChIKeyXCCSYXMCNLVBNF-UHFFFAOYSA-N
XLogP1.84
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.59
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[3-chloro-4-(difluoromethyl)-5-iodo-2-pyridinyl]methanamine
CID 118808483
2-(aminomethyl)-4-(difluoromethyl)-5-hydroxypyridine-3-carbonitrile
CID 118831356
6-bromo-5-chloro-4-(difluoromethyl)pyridin-3-ol
CID 130107825
2-(aminomethyl)-3-chloro-5-(difluoromethyl)pyridin-4-amine
CID 118850860
6-(aminomethyl)-4-chloro-5-(difluoromethyl)pyridine-3-carbonitrile
CID 118825547
2-[2-(chloromethyl)-4-(difluoromethyl)-5-hydroxy-3-pyridinyl]acetic acid
CID 118815646
2-[4-(difluoromethyl)-5-hydroxy-3-iodo-2-pyridinyl]acetonitrile
CID 118852004
[5-amino-4-chloro-3-(difluoromethyl)-2-pyridinyl]methanol
CID 130102835
ethyl 6-(aminomethyl)-4-chloro-5-(difluoromethyl)pyridine-3-carboxylate
CID 134671019
6-chloro-4-(difluoromethyl)-5-methylpyridin-3-ol
CID 119014799
[4-(difluoromethyl)-3,5-difluoro-2-pyridinyl]methanamine
CID 130099744
6-(bromomethyl)-4-(difluoromethyl)-5-methylpyridin-3-ol
CID 130083686

Frequently Asked Questions

What is the IUPAC name of 6-(aminomethyl)-5-chloro-4-(difluoromethyl)pyridin-3-ol?
The IUPAC name of 6-(aminomethyl)-5-chloro-4-(difluoromethyl)pyridin-3-ol (CID 118825681) is 6-(aminomethyl)-5-chloro-4-(difluoromethyl)pyridin-3-ol.
What is the SMILES notation for 6-(aminomethyl)-5-chloro-4-(difluoromethyl)pyridin-3-ol?
The canonical SMILES for 6-(aminomethyl)-5-chloro-4-(difluoromethyl)pyridin-3-ol is NCc1ncc(O)c(C(F)F)c1Cl.
What is the InChIKey of 6-(aminomethyl)-5-chloro-4-(difluoromethyl)pyridin-3-ol?
The InChIKey is XCCSYXMCNLVBNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7ClF2N2O/c8-6-3(1-11)12-2-4(13)5(6)7(9)10/h2,7,13H,1,11H2.
What are the key properties of 6-(aminomethyl)-5-chloro-4-(difluoromethyl)pyridin-3-ol?
6-(aminomethyl)-5-chloro-4-(difluoromethyl)pyridin-3-ol has a molecular weight of 208.59 g/mol, XLogP of 1.84, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(aminomethyl)-5-chloro-4-(difluoromethyl)pyridin-3-ol is sourced from PubChem (CID 118825681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).