5-(aminomethyl)-4-methyl-3-(trifluoromethoxy)pyridin-2-amine

C8H10F3N3O — CID 119023642

IUPAC5-(aminomethyl)-4-methyl-3-(trifluoromethoxy)pyridin-2-amine
SMILESCc1c(CN)cnc(N)c1OC(F)(F)F
InChIInChI=1S/C8H10F3N3O/c1-4-5(2-12)3-14-7(13)6(4)15-8(9,10)11/h3H,2,12H2,1H3,(H2,13,14)
InChIKeyVRHRTVBSOQAEJN-UHFFFAOYSA-N
MW221.18 g/mol
LogP1.33
Rot. Bonds2

About 5-(aminomethyl)-4-methyl-3-(trifluoromethoxy)pyridin-2-amine

5-(aminomethyl)-4-methyl-3-(trifluoromethoxy)pyridin-2-amine (PubChem CID 119023642) has the molecular formula C8H10F3N3O and a molecular weight of 221.18 g/mol. Its IUPAC name is 5-(aminomethyl)-4-methyl-3-(trifluoromethoxy)pyridin-2-amine.

Molecular Properties

Compound Name5-(aminomethyl)-4-methyl-3-(trifluoromethoxy)pyridin-2-amine
PubChem CID119023642
Molecular FormulaC8H10F3N3O
Molecular Weight221.18 g/mol
Exact Mass221.08
IUPAC Name5-(aminomethyl)-4-methyl-3-(trifluoromethoxy)pyridin-2-amine
SMILESCc1c(CN)cnc(N)c1OC(F)(F)F
InChIInChI=1S/C8H10F3N3O/c1-4-5(2-12)3-14-7(13)6(4)15-8(9,10)11/h3H,2,12H2,1H3,(H2,13,14)
InChIKeyVRHRTVBSOQAEJN-UHFFFAOYSA-N
XLogP1.33
TPSA74.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.18
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-5-(aminomethyl)-3-(trifluoromethoxy)pyridine-4-carbonitrile
CID 119011895
methyl 5-(aminomethyl)-4-methyl-3-(trifluoromethoxy)pyridine-2-carboxylate
CID 133085417
2-[6-amino-4-(aminomethyl)-5-(trifluoromethoxy)-3-pyridinyl]acetonitrile
CID 118999485
6-amino-4-methyl-5-(trifluoromethoxy)pyridine-3-carbonitrile
CID 131630348
2-[2-amino-5-(aminomethyl)-4-(trifluoromethoxy)-3-pyridinyl]acetonitrile
CID 118990941
[4-iodo-5-methyl-6-(trifluoromethoxy)-3-pyridinyl]methanamine
CID 130112708
4-(aminomethyl)-6-methyl-3-(trifluoromethoxy)pyridin-2-amine
CID 119018318
6-amino-4-(aminomethyl)-5-(trifluoromethoxy)pyridin-3-ol
CID 119001508
[5-(aminomethyl)-2-methyl-4-(trifluoromethoxy)-3-pyridinyl]methanol
CID 134672505
[4,6-difluoro-5-(trifluoromethoxy)-3-pyridinyl]methanamine
CID 130094285
2-[5-(aminomethyl)-4-methyl-2-(trifluoromethoxy)-3-pyridinyl]acetonitrile
CID 134663767
[6-methyl-4-nitro-5-(trifluoromethoxy)-3-pyridinyl]methanamine
CID 134679983

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-4-methyl-3-(trifluoromethoxy)pyridin-2-amine?
The IUPAC name of 5-(aminomethyl)-4-methyl-3-(trifluoromethoxy)pyridin-2-amine (CID 119023642) is 5-(aminomethyl)-4-methyl-3-(trifluoromethoxy)pyridin-2-amine.
What is the SMILES notation for 5-(aminomethyl)-4-methyl-3-(trifluoromethoxy)pyridin-2-amine?
The canonical SMILES for 5-(aminomethyl)-4-methyl-3-(trifluoromethoxy)pyridin-2-amine is Cc1c(CN)cnc(N)c1OC(F)(F)F.
What is the InChIKey of 5-(aminomethyl)-4-methyl-3-(trifluoromethoxy)pyridin-2-amine?
The InChIKey is VRHRTVBSOQAEJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F3N3O/c1-4-5(2-12)3-14-7(13)6(4)15-8(9,10)11/h3H,2,12H2,1H3,(H2,13,14).
What are the key properties of 5-(aminomethyl)-4-methyl-3-(trifluoromethoxy)pyridin-2-amine?
5-(aminomethyl)-4-methyl-3-(trifluoromethoxy)pyridin-2-amine has a molecular weight of 221.18 g/mol, XLogP of 1.33, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-4-methyl-3-(trifluoromethoxy)pyridin-2-amine is sourced from PubChem (CID 119023642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).