N-[2-(dimethylamino)ethyl]-2-[methyl(2-phenylethyl)amino]-1,3-dihydroindene-2-carboxamide

C23H31N3O — CID 56912729

IUPACN-[2-(dimethylamino)ethyl]-2-[methyl(2-phenylethyl)amino]-1,3-dihydroindene-2-carboxamide
SMILESCN(C)CCNC(=O)C1(N(C)CCc2ccccc2)Cc2ccccc2C1
InChIInChI=1S/C23H31N3O/c1-25(2)16-14-24-22(27)23(17-20-11-7-8-12-21(20)18-23)26(3)15-13-19-9-5-4-6-10-19/h4-12H,13-18H2,1-3H3,(H,24,27)
InChIKeyGKDYXSSOINZIBQ-UHFFFAOYSA-N
MW365.52 g/mol
LogP2.38
Rot. Bonds8

About N-[2-(dimethylamino)ethyl]-2-[methyl(2-phenylethyl)amino]-1,3-dihydroindene-2-carboxamide

N-[2-(dimethylamino)ethyl]-2-[methyl(2-phenylethyl)amino]-1,3-dihydroindene-2-carboxamide (PubChem CID 56912729) has the molecular formula C23H31N3O and a molecular weight of 365.52 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-2-[methyl(2-phenylethyl)amino]-1,3-dihydroindene-2-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-2-[methyl(2-phenylethyl)amino]-1,3-dihydroindene-2-carboxamide
PubChem CID56912729
Molecular FormulaC23H31N3O
Molecular Weight365.52 g/mol
Exact Mass365.25
IUPAC NameN-[2-(dimethylamino)ethyl]-2-[methyl(2-phenylethyl)amino]-1,3-dihydroindene-2-carboxamide
SMILESCN(C)CCNC(=O)C1(N(C)CCc2ccccc2)Cc2ccccc2C1
InChIInChI=1S/C23H31N3O/c1-25(2)16-14-24-22(27)23(17-20-11-7-8-12-21(20)18-23)26(3)15-13-19-9-5-4-6-10-19/h4-12H,13-18H2,1-3H3,(H,24,27)
InChIKeyGKDYXSSOINZIBQ-UHFFFAOYSA-N
XLogP2.38
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.52
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-hydroxypropyl)-2-[methyl(2-phenylethyl)amino]-1,3-dihydroindene-2-carboxamide
CID 56892980
2-[methyl(2-phenylethyl)amino]-N-[(1S)-1-(1H-1,2,4-triazol-5-yl)ethyl]-1,3-dihydroindene-2-carboxamide
CID 26405728
2-[methyl(2-phenylethyl)amino]-N-[(3S)-oxan-3-yl]-1,3-dihydroindene-2-carboxamide
CID 95712632
[2-[methyl(2-phenylethyl)amino]-1,3-dihydroinden-2-yl]-piperazin-1-ylmethanone
CID 56896500
(4-methoxypiperidin-1-yl)-[2-[methyl(2-phenylethyl)amino]-1,3-dihydroinden-2-yl]methanone
CID 42516002
1-methyl-4-[2-[methyl(2-phenylethyl)amino]-1,3-dihydroindene-2-carbonyl]piperazin-2-one
CID 56893485
N-(1H-imidazol-2-ylmethyl)-N-methyl-2-[methyl(2-phenylethyl)amino]-1,3-dihydroindene-2-carboxamide
CID 56909102
N-[2-(dimethylamino)ethyl]-2,2-dimethyl-N'-(3-phenylpropyl)propanediamide
CID 108960228
2-[benzyl(methyl)amino]-N-[(3R,4R)-4-hydroxypyrrolidin-3-yl]-1,3-dihydroindene-2-carboxamide
CID 56897389
[3-(aminomethyl)piperidin-1-yl]-[2-[methyl(2-phenylethyl)amino]-1,3-dihydroinden-2-yl]methanone
CID 56904936
N-[2-(dimethylamino)ethyl]-2-(2-phenylethyl)benzamide
CID 71396924
2-[ethyl(methyl)amino]-1,3-dihydroindene-2-carboxylic acid
CID 82236410

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-2-[methyl(2-phenylethyl)amino]-1,3-dihydroindene-2-carboxamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-2-[methyl(2-phenylethyl)amino]-1,3-dihydroindene-2-carboxamide (CID 56912729) is N-[2-(dimethylamino)ethyl]-2-[methyl(2-phenylethyl)amino]-1,3-dihydroindene-2-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-2-[methyl(2-phenylethyl)amino]-1,3-dihydroindene-2-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-2-[methyl(2-phenylethyl)amino]-1,3-dihydroindene-2-carboxamide is CN(C)CCNC(=O)C1(N(C)CCc2ccccc2)Cc2ccccc2C1.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-2-[methyl(2-phenylethyl)amino]-1,3-dihydroindene-2-carboxamide?
The InChIKey is GKDYXSSOINZIBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H31N3O/c1-25(2)16-14-24-22(27)23(17-20-11-7-8-12-21(20)18-23)26(3)15-13-19-9-5-4-6-10-19/h4-12H,13-18H2,1-3H3,(H,24,27).
What are the key properties of N-[2-(dimethylamino)ethyl]-2-[methyl(2-phenylethyl)amino]-1,3-dihydroindene-2-carboxamide?
N-[2-(dimethylamino)ethyl]-2-[methyl(2-phenylethyl)amino]-1,3-dihydroindene-2-carboxamide has a molecular weight of 365.52 g/mol, XLogP of 2.38, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-2-[methyl(2-phenylethyl)amino]-1,3-dihydroindene-2-carboxamide is sourced from PubChem (CID 56912729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).