2-[[(1R)-2,3-dihydro-1H-inden-1-yl]-methylamino]-1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]ethanone

C21H24N2O — CID 36674560

IUPAC2-[[(1R)-2,3-dihydro-1H-inden-1-yl]-methylamino]-1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]ethanone
SMILESC[C@@H]1Cc2ccccc2N1C(=O)CN(C)[C@@H]1CCc2ccccc21
InChIInChI=1S/C21H24N2O/c1-15-13-17-8-4-6-10-19(17)23(15)21(24)14-22(2)20-12-11-16-7-3-5-9-18(16)20/h3-10,15,20H,11-14H2,1-2H3/t15-,20-/m1/s1
InChIKeyMZHKJKBRTVVPNC-FOIQADDNSA-N
MW320.44 g/mol
LogP3.58
Rot. Bonds3

About 2-[[(1R)-2,3-dihydro-1H-inden-1-yl]-methylamino]-1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]ethanone

2-[[(1R)-2,3-dihydro-1H-inden-1-yl]-methylamino]-1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]ethanone (PubChem CID 36674560) has the molecular formula C21H24N2O and a molecular weight of 320.44 g/mol. Its IUPAC name is 2-[[(1R)-2,3-dihydro-1H-inden-1-yl]-methylamino]-1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]ethanone.

Molecular Properties

Compound Name2-[[(1R)-2,3-dihydro-1H-inden-1-yl]-methylamino]-1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]ethanone
PubChem CID36674560
Molecular FormulaC21H24N2O
Molecular Weight320.44 g/mol
Exact Mass320.19
IUPAC Name2-[[(1R)-2,3-dihydro-1H-inden-1-yl]-methylamino]-1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]ethanone
SMILESC[C@@H]1Cc2ccccc2N1C(=O)CN(C)[C@@H]1CCc2ccccc21
InChIInChI=1S/C21H24N2O/c1-15-13-17-8-4-6-10-19(17)23(15)21(24)14-22(2)20-12-11-16-7-3-5-9-18(16)20/h3-10,15,20H,11-14H2,1-2H3/t15-,20-/m1/s1
InChIKeyMZHKJKBRTVVPNC-FOIQADDNSA-N
XLogP3.58
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.44
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[3-hydroxybutyl(methyl)amino]-1-(2-methyl-2,3-dihydroindol-1-yl)ethanone
CID 115665888
2-[2,3-dihydro-1H-inden-1-yl(methyl)amino]-1-(2,6-dimethylmorpholin-4-yl)ethanone
CID 134052196
2-(methylamino)-1-(2-methyl-2,3-dihydroindol-1-yl)ethanone;hydrochloride
CID 119669437
N-cyclopentyl-N-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]acetamide
CID 113159384
2-[methyl-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]amino]-N-(4-methylphenyl)acetamide
CID 8729209
2-[methyl-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]acetic acid
CID 118026509
1,2-bis(2-methyl-2,3-dihydroindol-1-yl)ethanone
CID 73142226
N-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]-N-(2-methylpropyl)acetamide
CID 113158988
1-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-3-(4-methylpiperazine-1,4-diium-1-yl)propan-1-one
CID 7330984
2-[2,3-dihydro-1H-inden-1-yl(methyl)amino]-N-(methylcarbamoyl)acetamide
CID 47147183
1-(2-methyl-2,3-dihydroindol-1-yl)-2-(4-methylpiperidin-1-yl)ethanone
CID 5296275
2-[(5-chloro-2-methoxyphenyl)methyl-methylamino]-1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]ethanone
CID 9136491

Frequently Asked Questions

What is the IUPAC name of 2-[[(1R)-2,3-dihydro-1H-inden-1-yl]-methylamino]-1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]ethanone?
The IUPAC name of 2-[[(1R)-2,3-dihydro-1H-inden-1-yl]-methylamino]-1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]ethanone (CID 36674560) is 2-[[(1R)-2,3-dihydro-1H-inden-1-yl]-methylamino]-1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]ethanone.
What is the SMILES notation for 2-[[(1R)-2,3-dihydro-1H-inden-1-yl]-methylamino]-1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]ethanone?
The canonical SMILES for 2-[[(1R)-2,3-dihydro-1H-inden-1-yl]-methylamino]-1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]ethanone is C[C@@H]1Cc2ccccc2N1C(=O)CN(C)[C@@H]1CCc2ccccc21.
What is the InChIKey of 2-[[(1R)-2,3-dihydro-1H-inden-1-yl]-methylamino]-1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]ethanone?
The InChIKey is MZHKJKBRTVVPNC-FOIQADDNSA-N. The full InChI is InChI=1S/C21H24N2O/c1-15-13-17-8-4-6-10-19(17)23(15)21(24)14-22(2)20-12-11-16-7-3-5-9-18(16)20/h3-10,15,20H,11-14H2,1-2H3/t15-,20-/m1/s1.
What are the key properties of 2-[[(1R)-2,3-dihydro-1H-inden-1-yl]-methylamino]-1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]ethanone?
2-[[(1R)-2,3-dihydro-1H-inden-1-yl]-methylamino]-1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]ethanone has a molecular weight of 320.44 g/mol, XLogP of 3.58, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(1R)-2,3-dihydro-1H-inden-1-yl]-methylamino]-1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]ethanone is sourced from PubChem (CID 36674560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).