N-[2-(dimethylamino)ethyl]-4-(6-ethyl-2,3-dihydro-1H-indol-5-yl)benzamide

C21H27N3O — CID 70866499

IUPACN-[2-(dimethylamino)ethyl]-4-(6-ethyl-2,3-dihydro-1H-indol-5-yl)benzamide
SMILESCCc1cc2c(cc1-c1ccc(C(=O)NCCN(C)C)cc1)CCN2
InChIInChI=1S/C21H27N3O/c1-4-15-14-20-18(9-10-22-20)13-19(15)16-5-7-17(8-6-16)21(25)23-11-12-24(2)3/h5-8,13-14,22H,4,9-12H2,1-3H3,(H,23,25)
InChIKeyZNJXYMWLDJLDAF-UHFFFAOYSA-N
MW337.47 g/mol
LogP3.18
Rot. Bonds6

About N-[2-(dimethylamino)ethyl]-4-(6-ethyl-2,3-dihydro-1H-indol-5-yl)benzamide

N-[2-(dimethylamino)ethyl]-4-(6-ethyl-2,3-dihydro-1H-indol-5-yl)benzamide (PubChem CID 70866499) has the molecular formula C21H27N3O and a molecular weight of 337.47 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-4-(6-ethyl-2,3-dihydro-1H-indol-5-yl)benzamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-4-(6-ethyl-2,3-dihydro-1H-indol-5-yl)benzamide
PubChem CID70866499
Molecular FormulaC21H27N3O
Molecular Weight337.47 g/mol
Exact Mass337.22
IUPAC NameN-[2-(dimethylamino)ethyl]-4-(6-ethyl-2,3-dihydro-1H-indol-5-yl)benzamide
SMILESCCc1cc2c(cc1-c1ccc(C(=O)NCCN(C)C)cc1)CCN2
InChIInChI=1S/C21H27N3O/c1-4-15-14-20-18(9-10-22-20)13-19(15)16-5-7-17(8-6-16)21(25)23-11-12-24(2)3/h5-8,13-14,22H,4,9-12H2,1-3H3,(H,23,25)
InChIKeyZNJXYMWLDJLDAF-UHFFFAOYSA-N
XLogP3.18
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.47
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[ethyl(methyl)amino]ethyl]-2,3-dihydro-1H-indole-5-carboxamide
CID 62641149
N-[2-(dimethylamino)ethyl]-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
CID 110761841
N-[2-[di(propan-2-yl)amino]ethyl]-2,3-dihydro-1H-indole-5-carboxamide
CID 43325545
N-[2-(dimethylamino)ethyl]-2-(1,2,3,4-tetrahydroquinolin-6-yl)benzamide
CID 70978428
N-pentyl-2,3-dihydro-1H-indole-5-carboxamide
CID 43142455
N-(2-acetamidoethyl)-2,3-dihydro-1H-indole-5-carboxamide
CID 43552874
N-[2-(dimethylamino)ethyl]-4-(3-oxo-2,4-dihydro-1H-1,3,5-triazin-3-ium-6-yl)benzamide
CID 57110416
4-N-(2,6-diethylphenyl)-1-N-[2-(dimethylamino)ethyl]benzene-1,4-dicarboxamide
CID 109045787
4-carbamothioyl-N-[2-(dimethylamino)ethyl]benzamide
CID 24701967
N-[2-(dimethylamino)ethyl]-4-sulfanylbenzamide
CID 107019569
N-[2-(dimethylamino)ethyl]-1,3-benzodioxole-5-carboxamide
CID 892533
N-[(2S)-2-hydroxypropyl]-2,3-dihydro-1H-indole-5-carboxamide
CID 93083353

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-4-(6-ethyl-2,3-dihydro-1H-indol-5-yl)benzamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-4-(6-ethyl-2,3-dihydro-1H-indol-5-yl)benzamide (CID 70866499) is N-[2-(dimethylamino)ethyl]-4-(6-ethyl-2,3-dihydro-1H-indol-5-yl)benzamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-4-(6-ethyl-2,3-dihydro-1H-indol-5-yl)benzamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-4-(6-ethyl-2,3-dihydro-1H-indol-5-yl)benzamide is CCc1cc2c(cc1-c1ccc(C(=O)NCCN(C)C)cc1)CCN2.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-4-(6-ethyl-2,3-dihydro-1H-indol-5-yl)benzamide?
The InChIKey is ZNJXYMWLDJLDAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H27N3O/c1-4-15-14-20-18(9-10-22-20)13-19(15)16-5-7-17(8-6-16)21(25)23-11-12-24(2)3/h5-8,13-14,22H,4,9-12H2,1-3H3,(H,23,25).
What are the key properties of N-[2-(dimethylamino)ethyl]-4-(6-ethyl-2,3-dihydro-1H-indol-5-yl)benzamide?
N-[2-(dimethylamino)ethyl]-4-(6-ethyl-2,3-dihydro-1H-indol-5-yl)benzamide has a molecular weight of 337.47 g/mol, XLogP of 3.18, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-4-(6-ethyl-2,3-dihydro-1H-indol-5-yl)benzamide is sourced from PubChem (CID 70866499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).