6-[2-methyl-6-(trifluoromethyl)-1H-indol-3-yl]pyridin-3-amine

C15H12F3N3 — CID 115110529

IUPAC6-[2-methyl-6-(trifluoromethyl)-1H-indol-3-yl]pyridin-3-amine
SMILESCc1[nH]c2cc(C(F)(F)F)ccc2c1-c1ccc(N)cn1
InChIInChI=1S/C15H12F3N3/c1-8-14(12-5-3-10(19)7-20-12)11-4-2-9(15(16,17)18)6-13(11)21-8/h2-7,21H,19H2,1H3
InChIKeyZNQBOIAHTGCPIR-UHFFFAOYSA-N
MW291.28 g/mol
LogP4.14
Rot. Bonds1

About 6-[2-methyl-6-(trifluoromethyl)-1H-indol-3-yl]pyridin-3-amine

6-[2-methyl-6-(trifluoromethyl)-1H-indol-3-yl]pyridin-3-amine (PubChem CID 115110529) has the molecular formula C15H12F3N3 and a molecular weight of 291.28 g/mol. Its IUPAC name is 6-[2-methyl-6-(trifluoromethyl)-1H-indol-3-yl]pyridin-3-amine.

Molecular Properties

Compound Name6-[2-methyl-6-(trifluoromethyl)-1H-indol-3-yl]pyridin-3-amine
PubChem CID115110529
Molecular FormulaC15H12F3N3
Molecular Weight291.28 g/mol
Exact Mass291.10
IUPAC Name6-[2-methyl-6-(trifluoromethyl)-1H-indol-3-yl]pyridin-3-amine
SMILESCc1[nH]c2cc(C(F)(F)F)ccc2c1-c1ccc(N)cn1
InChIInChI=1S/C15H12F3N3/c1-8-14(12-5-3-10(19)7-20-12)11-4-2-9(15(16,17)18)6-13(11)21-8/h2-7,21H,19H2,1H3
InChIKeyZNQBOIAHTGCPIR-UHFFFAOYSA-N
XLogP4.14
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.28
LogP ≤ 54.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-[2-methyl-6-(trifluoromethyl)-1H-indol-3-yl]-1,2-oxazol-5-amine
CID 136986044
5-[2-methyl-6-(trifluoromethyl)-1H-indol-3-yl]-1H-pyrazol-4-amine
CID 136986200
6-[2-methyl-4-(trifluoromethyl)phenyl]pyridin-3-amine
CID 102755510
3-(4-chlorophenyl)-2-methyl-6-(trifluoromethyl)-1H-indole
CID 141083856
3-chloro-2-methyl-7-(trifluoromethyl)-1H-quinolin-4-one
CID 121236449
2-tert-butyl-7-(trifluoromethyl)-9H-carbazole
CID 46855216
2,6-dimethyl-3-[6-[4-(trifluoromethyl)phenyl]-3-pyridinyl]-1H-pyridin-4-one
CID 70989962
6-[7-(trifluoromethyl)-1H-indol-2-yl]pyridin-3-amine
CID 115110370
3-(4,5-dihydro-1H-imidazol-2-yl)-2-methyl-5-(trifluoromethyl)-1H-indole
CID 10149294
6-[5-(trifluoromethoxy)-2-pyridinyl]pyridin-3-amine
CID 114281005
6-(5-amino-2-pyridinyl)pyridin-3-amine;dihydrochloride
CID 11557953
methyl 2-amino-6-(trifluoromethyl)-1H-indole-3-carboxylate
CID 614749

Frequently Asked Questions

What is the IUPAC name of 6-[2-methyl-6-(trifluoromethyl)-1H-indol-3-yl]pyridin-3-amine?
The IUPAC name of 6-[2-methyl-6-(trifluoromethyl)-1H-indol-3-yl]pyridin-3-amine (CID 115110529) is 6-[2-methyl-6-(trifluoromethyl)-1H-indol-3-yl]pyridin-3-amine.
What is the SMILES notation for 6-[2-methyl-6-(trifluoromethyl)-1H-indol-3-yl]pyridin-3-amine?
The canonical SMILES for 6-[2-methyl-6-(trifluoromethyl)-1H-indol-3-yl]pyridin-3-amine is Cc1[nH]c2cc(C(F)(F)F)ccc2c1-c1ccc(N)cn1.
What is the InChIKey of 6-[2-methyl-6-(trifluoromethyl)-1H-indol-3-yl]pyridin-3-amine?
The InChIKey is ZNQBOIAHTGCPIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12F3N3/c1-8-14(12-5-3-10(19)7-20-12)11-4-2-9(15(16,17)18)6-13(11)21-8/h2-7,21H,19H2,1H3.
What are the key properties of 6-[2-methyl-6-(trifluoromethyl)-1H-indol-3-yl]pyridin-3-amine?
6-[2-methyl-6-(trifluoromethyl)-1H-indol-3-yl]pyridin-3-amine has a molecular weight of 291.28 g/mol, XLogP of 4.14, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-methyl-6-(trifluoromethyl)-1H-indol-3-yl]pyridin-3-amine is sourced from PubChem (CID 115110529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).