[2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]phenyl]methanamine

C17H20N2 — CID 18071187

IUPAC[2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]phenyl]methanamine
SMILESCC1Cc2ccccc2N1Cc1ccccc1CN
InChIInChI=1S/C17H20N2/c1-13-10-14-6-4-5-9-17(14)19(13)12-16-8-3-2-7-15(16)11-18/h2-9,13H,10-12,18H2,1H3
InChIKeyFXSQPHAKPBHPQG-UHFFFAOYSA-N
MW252.36 g/mol
LogP3.10
Rot. Bonds3

About [2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]phenyl]methanamine

[2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]phenyl]methanamine (PubChem CID 18071187) has the molecular formula C17H20N2 and a molecular weight of 252.36 g/mol. Its IUPAC name is [2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]phenyl]methanamine.

Molecular Properties

Compound Name[2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]phenyl]methanamine
PubChem CID18071187
Molecular FormulaC17H20N2
Molecular Weight252.36 g/mol
Exact Mass252.16
IUPAC Name[2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]phenyl]methanamine
SMILESCC1Cc2ccccc2N1Cc1ccccc1CN
InChIInChI=1S/C17H20N2/c1-13-10-14-6-4-5-9-17(14)19(13)12-16-8-3-2-7-15(16)11-18/h2-9,13H,10-12,18H2,1H3
InChIKeyFXSQPHAKPBHPQG-UHFFFAOYSA-N
XLogP3.10
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[5-fluoro-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]phenyl]methanamine
CID 63288980
2-methyl-1-[(2-phenylphenyl)methyl]-2,3-dihydroindole
CID 70112663
[6-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-2-pyridinyl]methanamine
CID 106905554
2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]benzenecarboximidamide
CID 24695357
3-fluoro-4-[(2-methyl-2,3-dihydroindol-1-yl)methyl]aniline
CID 64769040
(1-ethyl-2-methyl-2,3-dihydroindol-7-yl)methanamine
CID 117203939
2-methyl-3-(2-methyl-2,3-dihydroindol-1-yl)propan-1-amine
CID 43367603
1-[(4-fluorophenyl)methyl]-2-methyl-2,3-dihydroindole
CID 22199928
2-[2-(2-methyl-2,3-dihydroindol-1-yl)ethyl]guanidine;hydroiodide
CID 110917258
3-fluoro-4-[(2-methyl-2,3-dihydroindol-1-yl)methyl]benzenecarboximidamide
CID 43185472
2-methyl-1-[(4-methylsulfanylphenyl)methyl]-2,3-dihydroindole
CID 173088754
[2,3-difluoro-4-(2-methyl-2,3-dihydroindol-1-yl)phenyl]methanamine
CID 107932681

Frequently Asked Questions

What is the IUPAC name of [2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]phenyl]methanamine?
The IUPAC name of [2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]phenyl]methanamine (CID 18071187) is [2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]phenyl]methanamine.
What is the SMILES notation for [2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]phenyl]methanamine?
The canonical SMILES for [2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]phenyl]methanamine is CC1Cc2ccccc2N1Cc1ccccc1CN.
What is the InChIKey of [2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]phenyl]methanamine?
The InChIKey is FXSQPHAKPBHPQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2/c1-13-10-14-6-4-5-9-17(14)19(13)12-16-8-3-2-7-15(16)11-18/h2-9,13H,10-12,18H2,1H3.
What are the key properties of [2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]phenyl]methanamine?
[2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]phenyl]methanamine has a molecular weight of 252.36 g/mol, XLogP of 3.10, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]phenyl]methanamine is sourced from PubChem (CID 18071187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).