6-amino-4-(aminomethyl)-5-(trifluoromethoxy)pyridin-3-ol

C7H8F3N3O2 — CID 119001508

IUPAC6-amino-4-(aminomethyl)-5-(trifluoromethoxy)pyridin-3-ol
SMILESNCc1c(O)cnc(N)c1OC(F)(F)F
InChIInChI=1S/C7H8F3N3O2/c8-7(9,10)15-5-3(1-11)4(14)2-13-6(5)12/h2,14H,1,11H2,(H2,12,13)
InChIKeyAPDYYZHGDGFNHQ-UHFFFAOYSA-N
MW223.15 g/mol
LogP0.73
Rot. Bonds2

About 6-amino-4-(aminomethyl)-5-(trifluoromethoxy)pyridin-3-ol

6-amino-4-(aminomethyl)-5-(trifluoromethoxy)pyridin-3-ol (PubChem CID 119001508) has the molecular formula C7H8F3N3O2 and a molecular weight of 223.15 g/mol. Its IUPAC name is 6-amino-4-(aminomethyl)-5-(trifluoromethoxy)pyridin-3-ol.

Molecular Properties

Compound Name6-amino-4-(aminomethyl)-5-(trifluoromethoxy)pyridin-3-ol
PubChem CID119001508
Molecular FormulaC7H8F3N3O2
Molecular Weight223.15 g/mol
Exact Mass223.06
IUPAC Name6-amino-4-(aminomethyl)-5-(trifluoromethoxy)pyridin-3-ol
SMILESNCc1c(O)cnc(N)c1OC(F)(F)F
InChIInChI=1S/C7H8F3N3O2/c8-7(9,10)15-5-3(1-11)4(14)2-13-6(5)12/h2,14H,1,11H2,(H2,12,13)
InChIKeyAPDYYZHGDGFNHQ-UHFFFAOYSA-N
XLogP0.73
TPSA94.39 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.15
LogP ≤ 50.73
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

4-(aminomethyl)-6-(difluoromethyl)-5-(trifluoromethoxy)pyridin-3-ol
CID 118801499
4-(aminomethyl)-6-nitro-5-(trifluoromethoxy)pyridin-3-ol
CID 118829972
2-[6-amino-4-(aminomethyl)-5-(trifluoromethoxy)-3-pyridinyl]acetonitrile
CID 118999485
3-(aminomethyl)-5-iodo-4-(trifluoromethoxy)pyridin-2-amine
CID 118993609
6-amino-4-(difluoromethyl)-5-(trifluoromethoxy)pyridin-3-ol
CID 119014102
3-(aminomethyl)-4-(trifluoromethoxy)-5-(trifluoromethyl)pyridin-2-amine
CID 119005601
[2-amino-5-(difluoromethyl)-3-(trifluoromethoxy)-4-pyridinyl]methanol
CID 118999909
2-[3-(aminomethyl)-5-hydroxy-4-(trifluoromethoxy)-2-pyridinyl]acetic acid
CID 134680395
5-(aminomethyl)-4-methyl-3-(trifluoromethoxy)pyridin-2-amine
CID 119023642
4-(aminomethyl)-5-(trifluoromethoxy)pyridin-3-ol
CID 118818649
ethyl 3-(aminomethyl)-5-hydroxy-4-(trifluoromethoxy)pyridine-2-carboxylate
CID 134665521
2-amino-5-(aminomethyl)-3-(trifluoromethoxy)pyridine-4-carbonitrile
CID 119011895

Frequently Asked Questions

What is the IUPAC name of 6-amino-4-(aminomethyl)-5-(trifluoromethoxy)pyridin-3-ol?
The IUPAC name of 6-amino-4-(aminomethyl)-5-(trifluoromethoxy)pyridin-3-ol (CID 119001508) is 6-amino-4-(aminomethyl)-5-(trifluoromethoxy)pyridin-3-ol.
What is the SMILES notation for 6-amino-4-(aminomethyl)-5-(trifluoromethoxy)pyridin-3-ol?
The canonical SMILES for 6-amino-4-(aminomethyl)-5-(trifluoromethoxy)pyridin-3-ol is NCc1c(O)cnc(N)c1OC(F)(F)F.
What is the InChIKey of 6-amino-4-(aminomethyl)-5-(trifluoromethoxy)pyridin-3-ol?
The InChIKey is APDYYZHGDGFNHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F3N3O2/c8-7(9,10)15-5-3(1-11)4(14)2-13-6(5)12/h2,14H,1,11H2,(H2,12,13).
What are the key properties of 6-amino-4-(aminomethyl)-5-(trifluoromethoxy)pyridin-3-ol?
6-amino-4-(aminomethyl)-5-(trifluoromethoxy)pyridin-3-ol has a molecular weight of 223.15 g/mol, XLogP of 0.73, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-4-(aminomethyl)-5-(trifluoromethoxy)pyridin-3-ol is sourced from PubChem (CID 119001508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).