3-(methylaminomethyl)-N-(2,4,6-trifluorophenyl)-1H-indol-6-amine

C16H14F3N3 — CID 134357602

IUPAC3-(methylaminomethyl)-N-(2,4,6-trifluorophenyl)-1H-indol-6-amine
SMILESCNCc1c[nH]c2cc(Nc3c(F)cc(F)cc3F)ccc12
InChIInChI=1S/C16H14F3N3/c1-20-7-9-8-21-15-6-11(2-3-12(9)15)22-16-13(18)4-10(17)5-14(16)19/h2-6,8,20-22H,7H2,1H3
InChIKeyHGFNAWUVKSJWOV-UHFFFAOYSA-N
MW305.30 g/mol
LogP4.05
Rot. Bonds4

About 3-(methylaminomethyl)-N-(2,4,6-trifluorophenyl)-1H-indol-6-amine

3-(methylaminomethyl)-N-(2,4,6-trifluorophenyl)-1H-indol-6-amine (PubChem CID 134357602) has the molecular formula C16H14F3N3 and a molecular weight of 305.30 g/mol. Its IUPAC name is 3-(methylaminomethyl)-N-(2,4,6-trifluorophenyl)-1H-indol-6-amine.

Molecular Properties

Compound Name3-(methylaminomethyl)-N-(2,4,6-trifluorophenyl)-1H-indol-6-amine
PubChem CID134357602
Molecular FormulaC16H14F3N3
Molecular Weight305.30 g/mol
Exact Mass305.11
IUPAC Name3-(methylaminomethyl)-N-(2,4,6-trifluorophenyl)-1H-indol-6-amine
SMILESCNCc1c[nH]c2cc(Nc3c(F)cc(F)cc3F)ccc12
InChIInChI=1S/C16H14F3N3/c1-20-7-9-8-21-15-6-11(2-3-12(9)15)22-16-13(18)4-10(17)5-14(16)19/h2-6,8,20-22H,7H2,1H3
InChIKeyHGFNAWUVKSJWOV-UHFFFAOYSA-N
XLogP4.05
TPSA39.85 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.30
LogP ≤ 54.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Analyze 3-(methylaminomethyl)-N-(2,4,6-trifluorophenyl)-1H-indol-6-amine 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

N-methyl-1-(6-methyl-1H-indol-3-yl)methanamine
CID 68579797
N-[2-chloro-4-(trifluoromethoxy)phenyl]-3-(methylaminomethyl)-1H-indol-6-amine
CID 134357306
[3-(methylaminomethyl)-1H-indol-6-yl]methanamine
CID 117178238
1-[6-[(2,3-difluoro-4-methylphenyl)methyl]-1H-indol-3-yl]-N-methylmethanamine
CID 134357248
N-(2-fluoro-6-methyl-3-pyridinyl)-3-(methylaminomethyl)-1H-indol-6-amine;pyridine-3-thiol
CID 144821489
(2Z,4E)-6-fluoro-5-N-[3-(methylaminomethyl)-1H-indol-6-yl]hepta-2,4-diene-2,5-diamine
CID 134357243
2-chloro-4,6-difluoro-N-(1H-indol-3-ylmethyl)aniline
CID 83081633
1-[6-(3-chlorophenyl)-1H-indol-3-yl]-N-methylmethanamine
CID 134357369
3-(methylaminomethyl)-N-[2-methyl-6-(trifluoromethyl)-3-pyridinyl]-1H-indol-6-amine;pyridine-3-thiol
CID 144821362
N-(4-bromo-2-ethylphenyl)-3-(methylaminomethyl)-1H-indol-6-amine;pyridine-3-thiol
CID 144821354
1-[5-chloro-2-[(6-fluoro-1H-indol-3-yl)sulfanyl]phenyl]-N-methylmethanamine
CID 68540753
N-(6-methoxy-2-methyl-3-pyridinyl)-3-(methylaminomethyl)-1H-indol-6-amine;pyridine-3-thiol
CID 144821388

Frequently Asked Questions

What is the IUPAC name of 3-(methylaminomethyl)-N-(2,4,6-trifluorophenyl)-1H-indol-6-amine?
The IUPAC name of 3-(methylaminomethyl)-N-(2,4,6-trifluorophenyl)-1H-indol-6-amine (CID 134357602) is 3-(methylaminomethyl)-N-(2,4,6-trifluorophenyl)-1H-indol-6-amine.
What is the SMILES notation for 3-(methylaminomethyl)-N-(2,4,6-trifluorophenyl)-1H-indol-6-amine?
The canonical SMILES for 3-(methylaminomethyl)-N-(2,4,6-trifluorophenyl)-1H-indol-6-amine is CNCc1c[nH]c2cc(Nc3c(F)cc(F)cc3F)ccc12.
What is the InChIKey of 3-(methylaminomethyl)-N-(2,4,6-trifluorophenyl)-1H-indol-6-amine?
The InChIKey is HGFNAWUVKSJWOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14F3N3/c1-20-7-9-8-21-15-6-11(2-3-12(9)15)22-16-13(18)4-10(17)5-14(16)19/h2-6,8,20-22H,7H2,1H3.
What are the key properties of 3-(methylaminomethyl)-N-(2,4,6-trifluorophenyl)-1H-indol-6-amine?
3-(methylaminomethyl)-N-(2,4,6-trifluorophenyl)-1H-indol-6-amine has a molecular weight of 305.30 g/mol, XLogP of 4.05, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methylaminomethyl)-N-(2,4,6-trifluorophenyl)-1H-indol-6-amine is sourced from PubChem (CID 134357602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).