N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-(2,2,2-trifluoroethyl)propan-2-amine

C14H19F3N2 — CID 55008667

IUPACN-(2,3-dihydro-1H-indol-5-ylmethyl)-N-(2,2,2-trifluoroethyl)propan-2-amine
SMILESCC(C)N(Cc1ccc2c(c1)CCN2)CC(F)(F)F
InChIInChI=1S/C14H19F3N2/c1-10(2)19(9-14(15,16)17)8-11-3-4-13-12(7-11)5-6-18-13/h3-4,7,10,18H,5-6,8-9H2,1-2H3
InChIKeyLHWMJWDJWSURIY-UHFFFAOYSA-N
MW272.31 g/mol
LogP3.43
Rot. Bonds4

About N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-(2,2,2-trifluoroethyl)propan-2-amine

N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-(2,2,2-trifluoroethyl)propan-2-amine (PubChem CID 55008667) has the molecular formula C14H19F3N2 and a molecular weight of 272.31 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-(2,2,2-trifluoroethyl)propan-2-amine.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-indol-5-ylmethyl)-N-(2,2,2-trifluoroethyl)propan-2-amine
PubChem CID55008667
Molecular FormulaC14H19F3N2
Molecular Weight272.31 g/mol
Exact Mass272.15
IUPAC NameN-(2,3-dihydro-1H-indol-5-ylmethyl)-N-(2,2,2-trifluoroethyl)propan-2-amine
SMILESCC(C)N(Cc1ccc2c(c1)CCN2)CC(F)(F)F
InChIInChI=1S/C14H19F3N2/c1-10(2)19(9-14(15,16)17)8-11-3-4-13-12(7-11)5-6-18-13/h3-4,7,10,18H,5-6,8-9H2,1-2H3
InChIKeyLHWMJWDJWSURIY-UHFFFAOYSA-N
XLogP3.43
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.31
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-propan-2-yl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)propan-1-amine
CID 43269701
N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-ethylethanamine
CID 22898575
N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-methyl-1-methylsulfanylpropan-2-amine
CID 112661085
N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-(2-methylpropyl)cyclopropanamine
CID 55001070
N-[1-(2,3-dihydro-1H-indol-5-yl)propan-2-yl]-2,4,4-trimethylpentan-2-amine
CID 82257057
N-(2,3-dihydro-1H-indol-5-ylmethyl)-2,3,3-trimethylbutan-1-amine
CID 83144156
1-(2,3-dihydro-1H-indol-5-yl)-N-methyl-N-(thiophen-2-ylmethyl)methanamine
CID 43527635
1-(2,3-dihydro-1H-indol-5-yl)-N-methyl-N-(pyridin-3-ylmethyl)methanamine
CID 43563498
3-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]benzonitrile
CID 55010940
N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-(2-methoxyethyl)-2-methylpropan-1-amine
CID 54985987
N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)propan-2-amine
CID 61151541
2,2,2-trifluoro-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)ethanamine
CID 61150769

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-(2,2,2-trifluoroethyl)propan-2-amine?
The IUPAC name of N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-(2,2,2-trifluoroethyl)propan-2-amine (CID 55008667) is N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-(2,2,2-trifluoroethyl)propan-2-amine.
What is the SMILES notation for N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-(2,2,2-trifluoroethyl)propan-2-amine?
The canonical SMILES for N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-(2,2,2-trifluoroethyl)propan-2-amine is CC(C)N(Cc1ccc2c(c1)CCN2)CC(F)(F)F.
What is the InChIKey of N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-(2,2,2-trifluoroethyl)propan-2-amine?
The InChIKey is LHWMJWDJWSURIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19F3N2/c1-10(2)19(9-14(15,16)17)8-11-3-4-13-12(7-11)5-6-18-13/h3-4,7,10,18H,5-6,8-9H2,1-2H3.
What are the key properties of N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-(2,2,2-trifluoroethyl)propan-2-amine?
N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-(2,2,2-trifluoroethyl)propan-2-amine has a molecular weight of 272.31 g/mol, XLogP of 3.43, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-(2,2,2-trifluoroethyl)propan-2-amine is sourced from PubChem (CID 55008667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).