N-(4-methoxy-2,3-dihydro-1H-inden-1-yl)-3-(trifluoromethyl)pyridin-2-amine

C16H15F3N2O — CID 133361642

IUPACN-(4-methoxy-2,3-dihydro-1H-inden-1-yl)-3-(trifluoromethyl)pyridin-2-amine
SMILESCOc1cccc2c1CCC2Nc1ncccc1C(F)(F)F
InChIInChI=1S/C16H15F3N2O/c1-22-14-6-2-4-10-11(14)7-8-13(10)21-15-12(16(17,18)19)5-3-9-20-15/h2-6,9,13H,7-8H2,1H3,(H,20,21)
InChIKeyANWOSCKXPJCDOP-UHFFFAOYSA-N
MW308.30 g/mol
LogP4.21
Rot. Bonds3

About N-(4-methoxy-2,3-dihydro-1H-inden-1-yl)-3-(trifluoromethyl)pyridin-2-amine

N-(4-methoxy-2,3-dihydro-1H-inden-1-yl)-3-(trifluoromethyl)pyridin-2-amine (PubChem CID 133361642) has the molecular formula C16H15F3N2O and a molecular weight of 308.30 g/mol. Its IUPAC name is N-(4-methoxy-2,3-dihydro-1H-inden-1-yl)-3-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound NameN-(4-methoxy-2,3-dihydro-1H-inden-1-yl)-3-(trifluoromethyl)pyridin-2-amine
PubChem CID133361642
Molecular FormulaC16H15F3N2O
Molecular Weight308.30 g/mol
Exact Mass308.11
IUPAC NameN-(4-methoxy-2,3-dihydro-1H-inden-1-yl)-3-(trifluoromethyl)pyridin-2-amine
SMILESCOc1cccc2c1CCC2Nc1ncccc1C(F)(F)F
InChIInChI=1S/C16H15F3N2O/c1-22-14-6-2-4-10-11(14)7-8-13(10)21-15-12(16(17,18)19)5-3-9-20-15/h2-6,9,13H,7-8H2,1H3,(H,20,21)
InChIKeyANWOSCKXPJCDOP-UHFFFAOYSA-N
XLogP4.21
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.30
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-chloro-N-(4-methoxy-2,3-dihydro-1H-inden-1-yl)pyridin-2-amine
CID 133361766
3-[(4-methoxy-2,3-dihydro-1H-inden-1-yl)amino]pyrazine-2-carbonitrile
CID 133361670
N-(4-methoxy-2,3-dihydro-1H-inden-1-yl)pyrazin-2-amine
CID 133361794
N-ethyl-4-methoxy-2,3-dihydro-1H-inden-1-amine
CID 61383418
6-tert-butylsulfonyl-N-(4-methoxy-2,3-dihydro-1H-inden-1-yl)pyridin-3-amine
CID 133361710
N-(4-methoxy-2,3-dihydro-1H-inden-1-yl)-2-methylsulfanyl-[1,3]thiazolo[4,5-d]pyrimidin-7-amine
CID 133361669
N-(3-methoxy-2,2-dimethylcyclobutyl)-3-(trifluoromethyl)pyridin-2-amine
CID 103742782
N-(2-methylcyclopropyl)-3-(trifluoromethyl)pyridin-2-amine
CID 62397155
4-methoxy-N-(4-nitrophenyl)-2,3-dihydro-1H-inden-1-amine
CID 133361598
2-tert-butyl-N-(4-methoxy-2,3-dihydro-1H-inden-1-yl)-6-(methoxymethyl)pyrimidin-4-amine
CID 133412619
(2S)-2-amino-N-(4-methoxy-2,3-dihydro-1H-inden-1-yl)propanamide
CID 119317459
4-bromo-N-(2-methoxyphenyl)-2,3-dihydro-1H-inden-1-amine
CID 103930811

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxy-2,3-dihydro-1H-inden-1-yl)-3-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of N-(4-methoxy-2,3-dihydro-1H-inden-1-yl)-3-(trifluoromethyl)pyridin-2-amine (CID 133361642) is N-(4-methoxy-2,3-dihydro-1H-inden-1-yl)-3-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for N-(4-methoxy-2,3-dihydro-1H-inden-1-yl)-3-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for N-(4-methoxy-2,3-dihydro-1H-inden-1-yl)-3-(trifluoromethyl)pyridin-2-amine is COc1cccc2c1CCC2Nc1ncccc1C(F)(F)F.
What is the InChIKey of N-(4-methoxy-2,3-dihydro-1H-inden-1-yl)-3-(trifluoromethyl)pyridin-2-amine?
The InChIKey is ANWOSCKXPJCDOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15F3N2O/c1-22-14-6-2-4-10-11(14)7-8-13(10)21-15-12(16(17,18)19)5-3-9-20-15/h2-6,9,13H,7-8H2,1H3,(H,20,21).
What are the key properties of N-(4-methoxy-2,3-dihydro-1H-inden-1-yl)-3-(trifluoromethyl)pyridin-2-amine?
N-(4-methoxy-2,3-dihydro-1H-inden-1-yl)-3-(trifluoromethyl)pyridin-2-amine has a molecular weight of 308.30 g/mol, XLogP of 4.21, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxy-2,3-dihydro-1H-inden-1-yl)-3-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 133361642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).