6-[3-(trifluoromethyl)piperidin-1-yl]pyridine-2,3-diamine

C11H15F3N4 — CID 79825633

IUPAC6-[3-(trifluoromethyl)piperidin-1-yl]pyridine-2,3-diamine
SMILESNc1ccc(N2CCCC(C(F)(F)F)C2)nc1N
InChIInChI=1S/C11H15F3N4/c12-11(13,14)7-2-1-5-18(6-7)9-4-3-8(15)10(16)17-9/h3-4,7H,1-2,5-6,15H2,(H2,16,17)
InChIKeyWGUVOJJWCSEFGL-UHFFFAOYSA-N
MW260.26 g/mol
LogP2.02
Rot. Bonds1

About 6-[3-(trifluoromethyl)piperidin-1-yl]pyridine-2,3-diamine

6-[3-(trifluoromethyl)piperidin-1-yl]pyridine-2,3-diamine (PubChem CID 79825633) has the molecular formula C11H15F3N4 and a molecular weight of 260.26 g/mol. Its IUPAC name is 6-[3-(trifluoromethyl)piperidin-1-yl]pyridine-2,3-diamine.

Molecular Properties

Compound Name6-[3-(trifluoromethyl)piperidin-1-yl]pyridine-2,3-diamine
PubChem CID79825633
Molecular FormulaC11H15F3N4
Molecular Weight260.26 g/mol
Exact Mass260.12
IUPAC Name6-[3-(trifluoromethyl)piperidin-1-yl]pyridine-2,3-diamine
SMILESNc1ccc(N2CCCC(C(F)(F)F)C2)nc1N
InChIInChI=1S/C11H15F3N4/c12-11(13,14)7-2-1-5-18(6-7)9-4-3-8(15)10(16)17-9/h3-4,7H,1-2,5-6,15H2,(H2,16,17)
InChIKeyWGUVOJJWCSEFGL-UHFFFAOYSA-N
XLogP2.02
TPSA68.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.26
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 6-[3-(trifluoromethyl)piperidin-1-yl]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-[(3S)-3-(trifluoromethyl)piperidin-1-yl]pyridin-3-amine
CID 129372273
6-methoxy-2-[3-(trifluoromethyl)piperidin-1-yl]pyridin-3-amine
CID 115320894
4-[(3S)-3-(trifluoromethyl)piperidin-1-yl]aniline
CID 97044380
3-[3-(trifluoromethyl)piperidin-1-yl]pyridin-2-amine
CID 104540507
[6-[3-(trifluoromethyl)piperidin-1-yl]pyrazin-2-yl]methanamine
CID 66449158
6-[3-(trifluoromethyl)pyrrolidin-1-yl]pyrido[3,2-d]pyrimidin-4-amine
CID 90016788
2-methylsulfanyl-6-[3-(trifluoromethyl)piperidin-1-yl]pyrimidin-4-amine
CID 80847671
6-[(3R)-3-(trifluoromethyl)pyrrolidin-1-yl]pyridin-3-amine
CID 129320766
5-[3-(trifluoromethyl)piperidin-1-yl]-1,6,8-triazatricyclo[7.3.1.02,7]trideca-2(7),3,5,9(13)-tetraene
CID 144746669
methyl 5-amino-6-[3-(trifluoromethyl)piperidin-1-yl]pyridine-2-carboxylate
CID 114406868
2,3-diamino-6-[3-(trifluoromethyl)piperidin-1-yl]benzonitrile
CID 67958270
4-N-ethyl-6-[3-(trifluoromethyl)piperidin-1-yl]pyrimidine-2,4-diamine
CID 80847307

Frequently Asked Questions

What is the IUPAC name of 6-[3-(trifluoromethyl)piperidin-1-yl]pyridine-2,3-diamine?
The IUPAC name of 6-[3-(trifluoromethyl)piperidin-1-yl]pyridine-2,3-diamine (CID 79825633) is 6-[3-(trifluoromethyl)piperidin-1-yl]pyridine-2,3-diamine.
What is the SMILES notation for 6-[3-(trifluoromethyl)piperidin-1-yl]pyridine-2,3-diamine?
The canonical SMILES for 6-[3-(trifluoromethyl)piperidin-1-yl]pyridine-2,3-diamine is Nc1ccc(N2CCCC(C(F)(F)F)C2)nc1N.
What is the InChIKey of 6-[3-(trifluoromethyl)piperidin-1-yl]pyridine-2,3-diamine?
The InChIKey is WGUVOJJWCSEFGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15F3N4/c12-11(13,14)7-2-1-5-18(6-7)9-4-3-8(15)10(16)17-9/h3-4,7H,1-2,5-6,15H2,(H2,16,17).
What are the key properties of 6-[3-(trifluoromethyl)piperidin-1-yl]pyridine-2,3-diamine?
6-[3-(trifluoromethyl)piperidin-1-yl]pyridine-2,3-diamine has a molecular weight of 260.26 g/mol, XLogP of 2.02, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-(trifluoromethyl)piperidin-1-yl]pyridine-2,3-diamine is sourced from PubChem (CID 79825633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).