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

C17H19FN2 — CID 63288980

IUPAC[5-fluoro-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]phenyl]methanamine
SMILESCC1Cc2ccccc2N1Cc1ccc(F)cc1CN
InChIInChI=1S/C17H19FN2/c1-12-8-13-4-2-3-5-17(13)20(12)11-14-6-7-16(18)9-15(14)10-19/h2-7,9,12H,8,10-11,19H2,1H3
InChIKeyCARUQUVZUUUVAM-UHFFFAOYSA-N
MW270.35 g/mol
LogP3.24
Rot. Bonds3

About [5-fluoro-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]phenyl]methanamine

[5-fluoro-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]phenyl]methanamine (PubChem CID 63288980) has the molecular formula C17H19FN2 and a molecular weight of 270.35 g/mol. Its IUPAC name is [5-fluoro-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]phenyl]methanamine.

Molecular Properties

Compound Name[5-fluoro-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]phenyl]methanamine
PubChem CID63288980
Molecular FormulaC17H19FN2
Molecular Weight270.35 g/mol
Exact Mass270.15
IUPAC Name[5-fluoro-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]phenyl]methanamine
SMILESCC1Cc2ccccc2N1Cc1ccc(F)cc1CN
InChIInChI=1S/C17H19FN2/c1-12-8-13-4-2-3-5-17(13)20(12)11-14-6-7-16(18)9-15(14)10-19/h2-7,9,12H,8,10-11,19H2,1H3
InChIKeyCARUQUVZUUUVAM-UHFFFAOYSA-N
XLogP3.24
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.35
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]phenyl]methanamine
CID 18071187
3-fluoro-4-[(2-methyl-2,3-dihydroindol-1-yl)methyl]aniline
CID 64769040
1-[(4-fluorophenyl)methyl]-2-methyl-2,3-dihydroindole
CID 22199928
3-fluoro-4-[(2-methyl-2,3-dihydroindol-1-yl)methyl]benzenecarboximidamide
CID 43185472
[2,3-difluoro-4-(2-methyl-2,3-dihydroindol-1-yl)phenyl]methanamine
CID 107932681
[5-fluoro-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]methanamine
CID 63551419
4-fluoro-3-[(2-methyl-2,3-dihydroindol-1-yl)methyl]benzenecarbothioamide
CID 43096906
[6-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-2-pyridinyl]methanamine
CID 106905554
[2-(1,3-dihydroisoindol-2-ylmethyl)-4-fluorophenyl]methanamine
CID 64769111
2-methyl-1-[(2-phenylphenyl)methyl]-2,3-dihydroindole
CID 70112663
2-(4-fluorophenyl)-4-[[(2R)-2-methyl-2,3-dihydroindol-1-yl]methyl]-1,3-oxazole
CID 31673406
2-(4-fluorophenyl)-4-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-1,3-oxazole
CID 42943788

Frequently Asked Questions

What is the IUPAC name of [5-fluoro-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]phenyl]methanamine?
The IUPAC name of [5-fluoro-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]phenyl]methanamine (CID 63288980) is [5-fluoro-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]phenyl]methanamine.
What is the SMILES notation for [5-fluoro-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]phenyl]methanamine?
The canonical SMILES for [5-fluoro-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]phenyl]methanamine is CC1Cc2ccccc2N1Cc1ccc(F)cc1CN.
What is the InChIKey of [5-fluoro-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]phenyl]methanamine?
The InChIKey is CARUQUVZUUUVAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN2/c1-12-8-13-4-2-3-5-17(13)20(12)11-14-6-7-16(18)9-15(14)10-19/h2-7,9,12H,8,10-11,19H2,1H3.
What are the key properties of [5-fluoro-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]phenyl]methanamine?
[5-fluoro-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]phenyl]methanamine has a molecular weight of 270.35 g/mol, XLogP of 3.24, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [5-fluoro-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]phenyl]methanamine is sourced from PubChem (CID 63288980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).