4-chloro-N-[[4-(trifluoromethyl)-2-pyridinyl]methyl]-1H-indol-6-amine

C15H11ClF3N3 — CID 155742371

IUPAC4-chloro-N-[[4-(trifluoromethyl)-2-pyridinyl]methyl]-1H-indol-6-amine
SMILESFC(F)(F)c1ccnc(CNc2cc(Cl)c3cc[nH]c3c2)c1
InChIInChI=1S/C15H11ClF3N3/c16-13-6-10(7-14-12(13)2-4-21-14)22-8-11-5-9(1-3-20-11)15(17,18)19/h1-7,21-22H,8H2
InChIKeyYXQQDFXCDKCPBE-UHFFFAOYSA-N
MW325.72 g/mol
LogP4.85
Rot. Bonds3

About 4-chloro-N-[[4-(trifluoromethyl)-2-pyridinyl]methyl]-1H-indol-6-amine

4-chloro-N-[[4-(trifluoromethyl)-2-pyridinyl]methyl]-1H-indol-6-amine (PubChem CID 155742371) has the molecular formula C15H11ClF3N3 and a molecular weight of 325.72 g/mol. Its IUPAC name is 4-chloro-N-[[4-(trifluoromethyl)-2-pyridinyl]methyl]-1H-indol-6-amine.

Molecular Properties

Compound Name4-chloro-N-[[4-(trifluoromethyl)-2-pyridinyl]methyl]-1H-indol-6-amine
PubChem CID155742371
Molecular FormulaC15H11ClF3N3
Molecular Weight325.72 g/mol
Exact Mass325.06
IUPAC Name4-chloro-N-[[4-(trifluoromethyl)-2-pyridinyl]methyl]-1H-indol-6-amine
SMILESFC(F)(F)c1ccnc(CNc2cc(Cl)c3cc[nH]c3c2)c1
InChIInChI=1S/C15H11ClF3N3/c16-13-6-10(7-14-12(13)2-4-21-14)22-8-11-5-9(1-3-20-11)15(17,18)19/h1-7,21-22H,8H2
InChIKeyYXQQDFXCDKCPBE-UHFFFAOYSA-N
XLogP4.85
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.72
LogP ≤ 54.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-chloro-N-[[4-(trifluoromethyl)-2-pyridinyl]methyl]-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

2-(chloromethyl)-4-(trifluoromethyl)pyridine;hydrochloride
CID 121232314
2-chloro-N-(pyridin-2-ylmethyl)-4-(trifluoromethyl)aniline
CID 43714578
2-(2H-tetrazol-5-ylmethyl)-4-(trifluoromethyl)pyridine
CID 124518140
N-[[4-(trifluoromethyl)-2-pyridinyl]methyl]cyclohexanecarboxamide
CID 142586783
3-chloro-N-(1H-imidazol-2-ylmethyl)-4-[5-(trifluoromethyl)-3-pyridinyl]aniline
CID 166397915
4-methyl-6-(trifluoromethyl)-1H-indole
CID 70228775
N-(4-chloro-1H-indol-6-yl)-6-[4-(trifluoromethyl)cyclohexyl]-1H-benzimidazol-2-amine
CID 164540030
N-(1H-indol-6-ylmethyl)-3-(trifluoromethyl)aniline
CID 102909173
N-(5-chloropentyl)-4-(trifluoromethyl)pyridin-2-amine
CID 107320732
6-[(4-chloro-1H-indol-6-yl)amino]-4-[3-chloro-5-(trifluoromethoxy)anilino]pyridine-2-carbonitrile
CID 164538848
2-methyl-N-[[4-(trifluoromethyl)-2-pyridinyl]methyl]pyrimidine-5-carboxamide
CID 118378317
2-chloro-4-methyl-N-[[3-(trifluoromethyl)phenyl]methyl]pyridin-3-amine
CID 65485316

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-[[4-(trifluoromethyl)-2-pyridinyl]methyl]-1H-indol-6-amine?
The IUPAC name of 4-chloro-N-[[4-(trifluoromethyl)-2-pyridinyl]methyl]-1H-indol-6-amine (CID 155742371) is 4-chloro-N-[[4-(trifluoromethyl)-2-pyridinyl]methyl]-1H-indol-6-amine.
What is the SMILES notation for 4-chloro-N-[[4-(trifluoromethyl)-2-pyridinyl]methyl]-1H-indol-6-amine?
The canonical SMILES for 4-chloro-N-[[4-(trifluoromethyl)-2-pyridinyl]methyl]-1H-indol-6-amine is FC(F)(F)c1ccnc(CNc2cc(Cl)c3cc[nH]c3c2)c1.
What is the InChIKey of 4-chloro-N-[[4-(trifluoromethyl)-2-pyridinyl]methyl]-1H-indol-6-amine?
The InChIKey is YXQQDFXCDKCPBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClF3N3/c16-13-6-10(7-14-12(13)2-4-21-14)22-8-11-5-9(1-3-20-11)15(17,18)19/h1-7,21-22H,8H2.
What are the key properties of 4-chloro-N-[[4-(trifluoromethyl)-2-pyridinyl]methyl]-1H-indol-6-amine?
4-chloro-N-[[4-(trifluoromethyl)-2-pyridinyl]methyl]-1H-indol-6-amine has a molecular weight of 325.72 g/mol, XLogP of 4.85, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-[[4-(trifluoromethyl)-2-pyridinyl]methyl]-1H-indol-6-amine is sourced from PubChem (CID 155742371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).