2-(1-adamantyl)-N-[1-[2-(dimethylamino)ethyl]indol-5-yl]acetamide

C24H33N3O — CID 20660002

IUPAC2-(1-adamantyl)-N-[1-[2-(dimethylamino)ethyl]indol-5-yl]acetamide
SMILESCN(C)CCn1ccc2cc(NC(=O)CC34CC5CC(CC(C5)C3)C4)ccc21
InChIInChI=1S/C24H33N3O/c1-26(2)7-8-27-6-5-20-12-21(3-4-22(20)27)25-23(28)16-24-13-17-9-18(14-24)11-19(10-17)15-24/h3-6,12,17-19H,7-11,13-16H2,1-2H3,(H,25,28)
InChIKeyGYMKSOIIDFMLQN-UHFFFAOYSA-N
MW379.55 g/mol
LogP4.75
Rot. Bonds6

About 2-(1-adamantyl)-N-[1-[2-(dimethylamino)ethyl]indol-5-yl]acetamide

2-(1-adamantyl)-N-[1-[2-(dimethylamino)ethyl]indol-5-yl]acetamide (PubChem CID 20660002) has the molecular formula C24H33N3O and a molecular weight of 379.55 g/mol. Its IUPAC name is 2-(1-adamantyl)-N-[1-[2-(dimethylamino)ethyl]indol-5-yl]acetamide.

Molecular Properties

Compound Name2-(1-adamantyl)-N-[1-[2-(dimethylamino)ethyl]indol-5-yl]acetamide
PubChem CID20660002
Molecular FormulaC24H33N3O
Molecular Weight379.55 g/mol
Exact Mass379.26
IUPAC Name2-(1-adamantyl)-N-[1-[2-(dimethylamino)ethyl]indol-5-yl]acetamide
SMILESCN(C)CCn1ccc2cc(NC(=O)CC34CC5CC(CC(C5)C3)C4)ccc21
InChIInChI=1S/C24H33N3O/c1-26(2)7-8-27-6-5-20-12-21(3-4-22(20)27)25-23(28)16-24-13-17-9-18(14-24)11-19(10-17)15-24/h3-6,12,17-19H,7-11,13-16H2,1-2H3,(H,25,28)
InChIKeyGYMKSOIIDFMLQN-UHFFFAOYSA-N
XLogP4.75
TPSA37.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.55
LogP ≤ 54.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

tert-butyl 2-[5-[[2-(1-adamantyl)acetyl]amino]indol-1-yl]acetate
CID 20660039
N-[1-[2-(dimethylamino)ethyl]indol-5-yl]-3-(2,5-dioxopyrrolidin-1-yl)propanamide
CID 49499379
N-[1-[2-(dimethylamino)ethyl]indol-6-yl]-2-(1-hydroxycyclopentyl)acetamide
CID 111539901
N-[2-[[1-[2-(dimethylamino)ethyl]indol-5-yl]amino]-2-oxoethyl]-2-phenylacetamide
CID 49499136
2-(1-adamantyl)-N-[2-[2-(dimethylamino)ethyl]-1-oxoisoquinolin-5-yl]acetamide
CID 25063414
CID 175926008
CID 175926008
1-[1-[2-(dimethylamino)ethyl]indol-5-yl]-3-[4-(2,6-dimethylmorpholin-4-yl)phenyl]urea
CID 91231245
1-amino-N-[1-[2-(dimethylamino)ethyl]indol-6-yl]cyclopropane-1-carboxamide
CID 119891229
1-(4-butylphenyl)-3-[1-[2-(dimethylamino)ethyl]indol-5-yl]urea
CID 91111671
1-[4-(dibutylamino)phenyl]-3-[1-[2-(dimethylamino)ethyl]indol-5-yl]urea
CID 91044427
N-[1-[2-(dimethylamino)ethyl]indol-5-yl]-2-[4-(3-oxobutyl)phenoxy]acetamide
CID 49498784
2-(1-adamantyl)-N-(1,3-diethyl-2-oxobenzimidazol-5-yl)acetamide
CID 3971481

Frequently Asked Questions

What is the IUPAC name of 2-(1-adamantyl)-N-[1-[2-(dimethylamino)ethyl]indol-5-yl]acetamide?
The IUPAC name of 2-(1-adamantyl)-N-[1-[2-(dimethylamino)ethyl]indol-5-yl]acetamide (CID 20660002) is 2-(1-adamantyl)-N-[1-[2-(dimethylamino)ethyl]indol-5-yl]acetamide.
What is the SMILES notation for 2-(1-adamantyl)-N-[1-[2-(dimethylamino)ethyl]indol-5-yl]acetamide?
The canonical SMILES for 2-(1-adamantyl)-N-[1-[2-(dimethylamino)ethyl]indol-5-yl]acetamide is CN(C)CCn1ccc2cc(NC(=O)CC34CC5CC(CC(C5)C3)C4)ccc21.
What is the InChIKey of 2-(1-adamantyl)-N-[1-[2-(dimethylamino)ethyl]indol-5-yl]acetamide?
The InChIKey is GYMKSOIIDFMLQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H33N3O/c1-26(2)7-8-27-6-5-20-12-21(3-4-22(20)27)25-23(28)16-24-13-17-9-18(14-24)11-19(10-17)15-24/h3-6,12,17-19H,7-11,13-16H2,1-2H3,(H,25,28).
What are the key properties of 2-(1-adamantyl)-N-[1-[2-(dimethylamino)ethyl]indol-5-yl]acetamide?
2-(1-adamantyl)-N-[1-[2-(dimethylamino)ethyl]indol-5-yl]acetamide has a molecular weight of 379.55 g/mol, XLogP of 4.75, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-adamantyl)-N-[1-[2-(dimethylamino)ethyl]indol-5-yl]acetamide is sourced from PubChem (CID 20660002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).