N-methyl-1-[1-(2-methylpropyl)-2,3-dihydroindol-6-yl]methanamine

C14H22N2 — CID 115105770

IUPACN-methyl-1-[1-(2-methylpropyl)-2,3-dihydroindol-6-yl]methanamine
SMILESCNCc1ccc2c(c1)N(CC(C)C)CC2
InChIInChI=1S/C14H22N2/c1-11(2)10-16-7-6-13-5-4-12(9-15-3)8-14(13)16/h4-5,8,11,15H,6-7,9-10H2,1-3H3
InChIKeyTYBGVHKDLALAIW-UHFFFAOYSA-N
MW218.34 g/mol
LogP2.42
Rot. Bonds4

About N-methyl-1-[1-(2-methylpropyl)-2,3-dihydroindol-6-yl]methanamine

N-methyl-1-[1-(2-methylpropyl)-2,3-dihydroindol-6-yl]methanamine (PubChem CID 115105770) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is N-methyl-1-[1-(2-methylpropyl)-2,3-dihydroindol-6-yl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[1-(2-methylpropyl)-2,3-dihydroindol-6-yl]methanamine
PubChem CID115105770
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC NameN-methyl-1-[1-(2-methylpropyl)-2,3-dihydroindol-6-yl]methanamine
SMILESCNCc1ccc2c(c1)N(CC(C)C)CC2
InChIInChI=1S/C14H22N2/c1-11(2)10-16-7-6-13-5-4-12(9-15-3)8-14(13)16/h4-5,8,11,15H,6-7,9-10H2,1-3H3
InChIKeyTYBGVHKDLALAIW-UHFFFAOYSA-N
XLogP2.42
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[1-(2-methylpropyl)-2,3-dihydroindol-6-yl]methanamine
CID 115105768
6-(difluoromethyl)-1-(2-methylpropyl)-2,3-dihydroindole
CID 174880450
2-[1-(2-methylpropyl)-2,3-dihydroindol-5-yl]ethanol
CID 115105893
N-methyl-2-(1-propyl-2,3-dihydroindol-6-yl)ethanamine
CID 115105803
1-(2-methylpropyl)-3,4-dihydro-2H-quinoline-7-carboxylic acid
CID 82263645
1-(6-bromo-2,3-dihydroindol-1-yl)propan-2-amine
CID 18735337
(3R)-4-(6-fluoro-2,3-dihydroindol-1-yl)-3-methylbutan-2-one
CID 146175141
1-(1-ethyl-2,3-dihydroindol-6-yl)propan-2-one
CID 115105745
2-[1-(cyclobutylmethyl)-2,3-dihydroindol-6-yl]-N-methylethanamine
CID 115105814
N-[1-(6-bromo-2,3-dihydroindol-1-yl)propan-2-yl]-3-methylbutan-1-amine
CID 18735361
1-methyl-6-(methylaminomethyl)-3H-indol-2-one
CID 82603428
1-(2-tert-butyl-1,3-dihydroisoindol-5-yl)-N-methylmethanamine
CID 82163744

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[1-(2-methylpropyl)-2,3-dihydroindol-6-yl]methanamine?
The IUPAC name of N-methyl-1-[1-(2-methylpropyl)-2,3-dihydroindol-6-yl]methanamine (CID 115105770) is N-methyl-1-[1-(2-methylpropyl)-2,3-dihydroindol-6-yl]methanamine.
What is the SMILES notation for N-methyl-1-[1-(2-methylpropyl)-2,3-dihydroindol-6-yl]methanamine?
The canonical SMILES for N-methyl-1-[1-(2-methylpropyl)-2,3-dihydroindol-6-yl]methanamine is CNCc1ccc2c(c1)N(CC(C)C)CC2.
What is the InChIKey of N-methyl-1-[1-(2-methylpropyl)-2,3-dihydroindol-6-yl]methanamine?
The InChIKey is TYBGVHKDLALAIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-11(2)10-16-7-6-13-5-4-12(9-15-3)8-14(13)16/h4-5,8,11,15H,6-7,9-10H2,1-3H3.
What are the key properties of N-methyl-1-[1-(2-methylpropyl)-2,3-dihydroindol-6-yl]methanamine?
N-methyl-1-[1-(2-methylpropyl)-2,3-dihydroindol-6-yl]methanamine has a molecular weight of 218.34 g/mol, XLogP of 2.42, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[1-(2-methylpropyl)-2,3-dihydroindol-6-yl]methanamine is sourced from PubChem (CID 115105770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).