N-benzyl-N-methyl-2-(2-methyl-2,3-dihydro-1H-indol-5-yl)ethanamine

C19H24N2 — CID 82255831

IUPACN-benzyl-N-methyl-2-(2-methyl-2,3-dihydro-1H-indol-5-yl)ethanamine
SMILESCC1Cc2cc(CCN(C)Cc3ccccc3)ccc2N1
InChIInChI=1S/C19H24N2/c1-15-12-18-13-16(8-9-19(18)20-15)10-11-21(2)14-17-6-4-3-5-7-17/h3-9,13,15,20H,10-12,14H2,1-2H3
InChIKeyIIYUKFRSXNYIPH-UHFFFAOYSA-N
MW280.41 g/mol
LogP3.72
Rot. Bonds5

About N-benzyl-N-methyl-2-(2-methyl-2,3-dihydro-1H-indol-5-yl)ethanamine

N-benzyl-N-methyl-2-(2-methyl-2,3-dihydro-1H-indol-5-yl)ethanamine (PubChem CID 82255831) has the molecular formula C19H24N2 and a molecular weight of 280.41 g/mol. Its IUPAC name is N-benzyl-N-methyl-2-(2-methyl-2,3-dihydro-1H-indol-5-yl)ethanamine.

Molecular Properties

Compound NameN-benzyl-N-methyl-2-(2-methyl-2,3-dihydro-1H-indol-5-yl)ethanamine
PubChem CID82255831
Molecular FormulaC19H24N2
Molecular Weight280.41 g/mol
Exact Mass280.19
IUPAC NameN-benzyl-N-methyl-2-(2-methyl-2,3-dihydro-1H-indol-5-yl)ethanamine
SMILESCC1Cc2cc(CCN(C)Cc3ccccc3)ccc2N1
InChIInChI=1S/C19H24N2/c1-15-12-18-13-16(8-9-19(18)20-15)10-11-21(2)14-17-6-4-3-5-7-17/h3-9,13,15,20H,10-12,14H2,1-2H3
InChIKeyIIYUKFRSXNYIPH-UHFFFAOYSA-N
XLogP3.72
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.41
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N',N'-dimethyl-N-[2-(2-methyl-2,3-dihydro-1H-indol-5-yl)ethyl]ethane-1,2-diamine
CID 82256995
5-ethyl-2-methyl-2,3-dihydro-1H-indole
CID 70571795
2-methyl-5-phenylmethoxy-2,3-dihydro-1H-indole
CID 166452154
2-[2-(2-methyl-2,3-dihydro-1H-indol-5-yl)ethylamino]ethanol
CID 82256939
2-(1,3-benzodioxol-5-yl)-N-benzyl-N-methylethanamine;ethane;ethene
CID 171532305
N-(2,3-dihydro-1H-indol-2-ylmethyl)-N-methyl-2-phenylethanamine
CID 80567527
N-methyl-2-phenyl-N-(pyridin-4-ylmethyl)ethanamine
CID 3817841
N-benzyl-N-methyl-2-pyridin-4-ylethanamine
CID 78793254
(2R)-2-methyl-2,3-dihydro-1H-indole;hydrochloride
CID 155819591
N-benzyl-N-methyl-2-[(2R)-oxiran-2-yl]ethanamine;N-benzyl-N-methyl-2-[(2S)-oxiran-2-yl]ethanamine
CID 161280376
N-[[4-(aminomethyl)phenyl]methyl]-N-methyl-2-(3-methylphenyl)ethanamine
CID 115213284
N-(2,3-dihydro-1H-isoindol-5-ylmethyl)-N-methyl-1-phenylmethanamine
CID 103997964

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-methyl-2-(2-methyl-2,3-dihydro-1H-indol-5-yl)ethanamine?
The IUPAC name of N-benzyl-N-methyl-2-(2-methyl-2,3-dihydro-1H-indol-5-yl)ethanamine (CID 82255831) is N-benzyl-N-methyl-2-(2-methyl-2,3-dihydro-1H-indol-5-yl)ethanamine.
What is the SMILES notation for N-benzyl-N-methyl-2-(2-methyl-2,3-dihydro-1H-indol-5-yl)ethanamine?
The canonical SMILES for N-benzyl-N-methyl-2-(2-methyl-2,3-dihydro-1H-indol-5-yl)ethanamine is CC1Cc2cc(CCN(C)Cc3ccccc3)ccc2N1.
What is the InChIKey of N-benzyl-N-methyl-2-(2-methyl-2,3-dihydro-1H-indol-5-yl)ethanamine?
The InChIKey is IIYUKFRSXNYIPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2/c1-15-12-18-13-16(8-9-19(18)20-15)10-11-21(2)14-17-6-4-3-5-7-17/h3-9,13,15,20H,10-12,14H2,1-2H3.
What are the key properties of N-benzyl-N-methyl-2-(2-methyl-2,3-dihydro-1H-indol-5-yl)ethanamine?
N-benzyl-N-methyl-2-(2-methyl-2,3-dihydro-1H-indol-5-yl)ethanamine has a molecular weight of 280.41 g/mol, XLogP of 3.72, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-methyl-2-(2-methyl-2,3-dihydro-1H-indol-5-yl)ethanamine is sourced from PubChem (CID 82255831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).