6-methoxy-2-N-[1-(trifluoromethyl)cyclopropyl]pyridine-2,3-diamine

C10H12F3N3O — CID 106217296

IUPAC6-methoxy-2-N-[1-(trifluoromethyl)cyclopropyl]pyridine-2,3-diamine
SMILESCOc1ccc(N)c(NC2(C(F)(F)F)CC2)n1
InChIInChI=1S/C10H12F3N3O/c1-17-7-3-2-6(14)8(15-7)16-9(4-5-9)10(11,12)13/h2-3H,4-5,14H2,1H3,(H,15,16)
InChIKeyGCUZLOSNJDAXSA-UHFFFAOYSA-N
MW247.22 g/mol
LogP2.18
Rot. Bonds3

About 6-methoxy-2-N-[1-(trifluoromethyl)cyclopropyl]pyridine-2,3-diamine

6-methoxy-2-N-[1-(trifluoromethyl)cyclopropyl]pyridine-2,3-diamine (PubChem CID 106217296) has the molecular formula C10H12F3N3O and a molecular weight of 247.22 g/mol. Its IUPAC name is 6-methoxy-2-N-[1-(trifluoromethyl)cyclopropyl]pyridine-2,3-diamine.

Molecular Properties

Compound Name6-methoxy-2-N-[1-(trifluoromethyl)cyclopropyl]pyridine-2,3-diamine
PubChem CID106217296
Molecular FormulaC10H12F3N3O
Molecular Weight247.22 g/mol
Exact Mass247.09
IUPAC Name6-methoxy-2-N-[1-(trifluoromethyl)cyclopropyl]pyridine-2,3-diamine
SMILESCOc1ccc(N)c(NC2(C(F)(F)F)CC2)n1
InChIInChI=1S/C10H12F3N3O/c1-17-7-3-2-6(14)8(15-7)16-9(4-5-9)10(11,12)13/h2-3H,4-5,14H2,1H3,(H,15,16)
InChIKeyGCUZLOSNJDAXSA-UHFFFAOYSA-N
XLogP2.18
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.22
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 6-methoxy-2-N-[1-(trifluoromethyl)cyclopropyl]pyridine-2,3-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-methoxy-2-N-methylpyridine-2,3-diamine;hydrochloride
CID 22731600
6-methoxy-2-N-(3,3,3-trifluoropropyl)pyridine-2,3-diamine
CID 115320787
2-[(3-amino-6-methoxy-2-pyridinyl)amino]-2-(hydroxymethyl)propane-1,3-diol
CID 107845624
6-methoxy-2-N-propan-2-ylpyridine-2,3-diamine
CID 115320271
6-ethoxy-2-N-[1-(trifluoromethyl)cyclopropyl]pyridine-2,5-diamine
CID 106217282
6-methoxy-2-N-(5,5,5-trifluoropentyl)pyridine-2,3-diamine
CID 115515515
[1-[(3-amino-6-methoxy-2-pyridinyl)amino]-3-methylcyclohexyl]methanol
CID 115320724
3-methoxy-N-[1-(trifluoromethyl)cyclopropyl]pyridin-2-amine
CID 106214712
6-methoxy-2-N-(4-methylpiperazin-1-yl)pyridine-2,3-diamine
CID 83005986
2-N-(3,5-difluorophenyl)-6-methoxypyridine-2,3-diamine
CID 115320365
2-N-cyclohexyl-6-methoxypyridine-2,3-diamine
CID 115320270
[1-[[(3-amino-6-methoxy-2-pyridinyl)amino]methyl]cyclohexyl]methanol
CID 103965461

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-N-[1-(trifluoromethyl)cyclopropyl]pyridine-2,3-diamine?
The IUPAC name of 6-methoxy-2-N-[1-(trifluoromethyl)cyclopropyl]pyridine-2,3-diamine (CID 106217296) is 6-methoxy-2-N-[1-(trifluoromethyl)cyclopropyl]pyridine-2,3-diamine.
What is the SMILES notation for 6-methoxy-2-N-[1-(trifluoromethyl)cyclopropyl]pyridine-2,3-diamine?
The canonical SMILES for 6-methoxy-2-N-[1-(trifluoromethyl)cyclopropyl]pyridine-2,3-diamine is COc1ccc(N)c(NC2(C(F)(F)F)CC2)n1.
What is the InChIKey of 6-methoxy-2-N-[1-(trifluoromethyl)cyclopropyl]pyridine-2,3-diamine?
The InChIKey is GCUZLOSNJDAXSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F3N3O/c1-17-7-3-2-6(14)8(15-7)16-9(4-5-9)10(11,12)13/h2-3H,4-5,14H2,1H3,(H,15,16).
What are the key properties of 6-methoxy-2-N-[1-(trifluoromethyl)cyclopropyl]pyridine-2,3-diamine?
6-methoxy-2-N-[1-(trifluoromethyl)cyclopropyl]pyridine-2,3-diamine has a molecular weight of 247.22 g/mol, XLogP of 2.18, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-N-[1-(trifluoromethyl)cyclopropyl]pyridine-2,3-diamine is sourced from PubChem (CID 106217296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).