[5-(trifluoromethyl)-1H-indol-2-yl]methanamine

C10H9F3N2 — CID 117195095

IUPAC[5-(trifluoromethyl)-1H-indol-2-yl]methanamine
SMILESNCc1cc2cc(C(F)(F)F)ccc2[nH]1
InChIInChI=1S/C10H9F3N2/c11-10(12,13)7-1-2-9-6(3-7)4-8(5-14)15-9/h1-4,15H,5,14H2
InChIKeyOUFXYTSMRLHHAY-UHFFFAOYSA-N
MW214.19 g/mol
LogP2.65
Rot. Bonds1

About [5-(trifluoromethyl)-1H-indol-2-yl]methanamine

[5-(trifluoromethyl)-1H-indol-2-yl]methanamine (PubChem CID 117195095) has the molecular formula C10H9F3N2 and a molecular weight of 214.19 g/mol. Its IUPAC name is [5-(trifluoromethyl)-1H-indol-2-yl]methanamine.

Molecular Properties

Compound Name[5-(trifluoromethyl)-1H-indol-2-yl]methanamine
PubChem CID117195095
Molecular FormulaC10H9F3N2
Molecular Weight214.19 g/mol
Exact Mass214.07
IUPAC Name[5-(trifluoromethyl)-1H-indol-2-yl]methanamine
SMILESNCc1cc2cc(C(F)(F)F)ccc2[nH]1
InChIInChI=1S/C10H9F3N2/c11-10(12,13)7-1-2-9-6(3-7)4-8(5-14)15-9/h1-4,15H,5,14H2
InChIKeyOUFXYTSMRLHHAY-UHFFFAOYSA-N
XLogP2.65
TPSA41.81 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.19
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

2-(aminomethyl)-1H-indol-5-ol
CID 14906013
[5-(trifluoromethyl)-1H-indol-2-yl]methyl propanoate
CID 174546520
N-methyl-3-[5-(trifluoromethyl)-1H-indol-2-yl]propan-1-amine
CID 117195108
3-chloro-6-(trifluoromethyl)-1H-quinolin-2-one
CID 146035766
[4-(trifluoromethyl)-1H-indol-2-yl]methanamine
CID 117194261
2-[2-oxo-6-(trifluoromethyl)-1H-quinolin-3-yl]acetic acid
CID 68754879
2-[[4-(trifluoromethyl)phenoxy]methyl]-1H-indol-5-ol
CID 117176788
5-tert-butyl-2-(trifluoromethyl)-1H-indole
CID 84629986
3-acetyl-6-(trifluoromethyl)-1H-quinolin-2-one
CID 122377198
N,N-dimethyl-5-(trifluoromethyl)-1H-indole-2-carboxamide
CID 126644745
1-methyl-5-[5-(trifluoromethyl)-1H-indol-2-yl]pyrazol-3-amine
CID 136985773
(6-methyl-1H-indol-2-yl)methanamine
CID 82502768

Frequently Asked Questions

What is the IUPAC name of [5-(trifluoromethyl)-1H-indol-2-yl]methanamine?
The IUPAC name of [5-(trifluoromethyl)-1H-indol-2-yl]methanamine (CID 117195095) is [5-(trifluoromethyl)-1H-indol-2-yl]methanamine.
What is the SMILES notation for [5-(trifluoromethyl)-1H-indol-2-yl]methanamine?
The canonical SMILES for [5-(trifluoromethyl)-1H-indol-2-yl]methanamine is NCc1cc2cc(C(F)(F)F)ccc2[nH]1.
What is the InChIKey of [5-(trifluoromethyl)-1H-indol-2-yl]methanamine?
The InChIKey is OUFXYTSMRLHHAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9F3N2/c11-10(12,13)7-1-2-9-6(3-7)4-8(5-14)15-9/h1-4,15H,5,14H2.
What are the key properties of [5-(trifluoromethyl)-1H-indol-2-yl]methanamine?
[5-(trifluoromethyl)-1H-indol-2-yl]methanamine has a molecular weight of 214.19 g/mol, XLogP of 2.65, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(trifluoromethyl)-1H-indol-2-yl]methanamine is sourced from PubChem (CID 117195095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).