4-(dimethylamino)-N-[2-(5-hydroxy-1-methylindol-3-yl)ethyl]benzamide

C20H23N3O2 — CID 84582508

IUPAC4-(dimethylamino)-N-[2-(5-hydroxy-1-methylindol-3-yl)ethyl]benzamide
SMILESCN(C)c1ccc(C(=O)NCCc2cn(C)c3ccc(O)cc23)cc1
InChIInChI=1S/C20H23N3O2/c1-22(2)16-6-4-14(5-7-16)20(25)21-11-10-15-13-23(3)19-9-8-17(24)12-18(15)19/h4-9,12-13,24H,10-11H2,1-3H3,(H,21,25)
InChIKeyJUBIWFASFBIEQR-UHFFFAOYSA-N
MW337.42 g/mol
LogP2.92
Rot. Bonds5

About 4-(dimethylamino)-N-[2-(5-hydroxy-1-methylindol-3-yl)ethyl]benzamide

4-(dimethylamino)-N-[2-(5-hydroxy-1-methylindol-3-yl)ethyl]benzamide (PubChem CID 84582508) has the molecular formula C20H23N3O2 and a molecular weight of 337.42 g/mol. Its IUPAC name is 4-(dimethylamino)-N-[2-(5-hydroxy-1-methylindol-3-yl)ethyl]benzamide.

Molecular Properties

Compound Name4-(dimethylamino)-N-[2-(5-hydroxy-1-methylindol-3-yl)ethyl]benzamide
PubChem CID84582508
Molecular FormulaC20H23N3O2
Molecular Weight337.42 g/mol
Exact Mass337.18
IUPAC Name4-(dimethylamino)-N-[2-(5-hydroxy-1-methylindol-3-yl)ethyl]benzamide
SMILESCN(C)c1ccc(C(=O)NCCc2cn(C)c3ccc(O)cc23)cc1
InChIInChI=1S/C20H23N3O2/c1-22(2)16-6-4-14(5-7-16)20(25)21-11-10-15-13-23(3)19-9-8-17(24)12-18(15)19/h4-9,12-13,24H,10-11H2,1-3H3,(H,21,25)
InChIKeyJUBIWFASFBIEQR-UHFFFAOYSA-N
XLogP2.92
TPSA57.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.42
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-fluoro-N-[2-(5-hydroxy-1-methylindol-3-yl)ethyl]benzamide
CID 84579411
5-bromo-N-[2-(5-hydroxy-1-methylindol-3-yl)ethyl]furan-2-carboxamide
CID 84579865
N-[2-(5-fluoro-1-methylindol-3-yl)ethyl]-4-morpholin-4-ylbenzamide
CID 46974700
N-[2-[[4-(dimethylamino)benzoyl]amino]ethyl]-3,5-dihydroxybenzamide
CID 108543039
N-[2-(2,4-difluorophenyl)ethyl]-4-(dimethylamino)benzamide
CID 110795613
4-(dimethylamino)-N-[2-hydroxy-2-(1-methylindol-3-yl)ethyl]benzamide
CID 90535031
4-(dimethylamino)-N-[2-[(2-phenylacetyl)amino]ethyl]benzamide
CID 108540008
4-(dimethylamino)-N-[2-[(2-methoxyacetyl)amino]ethyl]benzamide
CID 108542960
N-(2-benzamidoethyl)-4-(dimethylamino)benzamide
CID 38175898
N-[2-(1-methylindol-3-yl)ethyl]-2-phenylacetamide
CID 45069412
4-tert-butyl-N-[2-[[4-(dimethylamino)benzoyl]amino]ethyl]benzamide
CID 108542009
N-[2-(3,4-difluorophenyl)ethyl]-4-(dimethylamino)benzamide
CID 110795396

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylamino)-N-[2-(5-hydroxy-1-methylindol-3-yl)ethyl]benzamide?
The IUPAC name of 4-(dimethylamino)-N-[2-(5-hydroxy-1-methylindol-3-yl)ethyl]benzamide (CID 84582508) is 4-(dimethylamino)-N-[2-(5-hydroxy-1-methylindol-3-yl)ethyl]benzamide.
What is the SMILES notation for 4-(dimethylamino)-N-[2-(5-hydroxy-1-methylindol-3-yl)ethyl]benzamide?
The canonical SMILES for 4-(dimethylamino)-N-[2-(5-hydroxy-1-methylindol-3-yl)ethyl]benzamide is CN(C)c1ccc(C(=O)NCCc2cn(C)c3ccc(O)cc23)cc1.
What is the InChIKey of 4-(dimethylamino)-N-[2-(5-hydroxy-1-methylindol-3-yl)ethyl]benzamide?
The InChIKey is JUBIWFASFBIEQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O2/c1-22(2)16-6-4-14(5-7-16)20(25)21-11-10-15-13-23(3)19-9-8-17(24)12-18(15)19/h4-9,12-13,24H,10-11H2,1-3H3,(H,21,25).
What are the key properties of 4-(dimethylamino)-N-[2-(5-hydroxy-1-methylindol-3-yl)ethyl]benzamide?
4-(dimethylamino)-N-[2-(5-hydroxy-1-methylindol-3-yl)ethyl]benzamide has a molecular weight of 337.42 g/mol, XLogP of 2.92, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylamino)-N-[2-(5-hydroxy-1-methylindol-3-yl)ethyl]benzamide is sourced from PubChem (CID 84582508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).