2-(3,3-dimethyl-2-methylideneindol-1-yl)-N,N-diethylacetamide

C17H24N2O — CID 58298824

IUPAC2-(3,3-dimethyl-2-methylideneindol-1-yl)-N,N-diethylacetamide
SMILESC=C1N(CC(=O)N(CC)CC)c2ccccc2C1(C)C
InChIInChI=1S/C17H24N2O/c1-6-18(7-2)16(20)12-19-13(3)17(4,5)14-10-8-9-11-15(14)19/h8-11H,3,6-7,12H2,1-2,4-5H3
InChIKeyMMMJNEBHKYMEFQ-UHFFFAOYSA-N
MW272.39 g/mol
LogP3.17
Rot. Bonds4

About 2-(3,3-dimethyl-2-methylideneindol-1-yl)-N,N-diethylacetamide

2-(3,3-dimethyl-2-methylideneindol-1-yl)-N,N-diethylacetamide (PubChem CID 58298824) has the molecular formula C17H24N2O and a molecular weight of 272.39 g/mol. Its IUPAC name is 2-(3,3-dimethyl-2-methylideneindol-1-yl)-N,N-diethylacetamide.

Molecular Properties

Compound Name2-(3,3-dimethyl-2-methylideneindol-1-yl)-N,N-diethylacetamide
PubChem CID58298824
Molecular FormulaC17H24N2O
Molecular Weight272.39 g/mol
Exact Mass272.19
IUPAC Name2-(3,3-dimethyl-2-methylideneindol-1-yl)-N,N-diethylacetamide
SMILESC=C1N(CC(=O)N(CC)CC)c2ccccc2C1(C)C
InChIInChI=1S/C17H24N2O/c1-6-18(7-2)16(20)12-19-13(3)17(4,5)14-10-8-9-11-15(14)19/h8-11H,3,6-7,12H2,1-2,4-5H3
InChIKeyMMMJNEBHKYMEFQ-UHFFFAOYSA-N
XLogP3.17
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 53.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-(3,3-dimethyl-2-methylideneindol-1-yl)-N,N-diethylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2',4-dioxospiro[1,3-dihydroquinazoline-2,3'-indole]-1'-yl)-N,N-diethylacetamide
CID 3509796
N,N-diethyl-2-[(2E)-2-[[(3Z)-2-hydroxy-4-oxo-3-[(1,3,3-trimethylindol-1-ium-2-yl)methylidene]cyclobuten-1-yl]methylidene]-3,3-dimethylindol-1-yl]acetamide
CID 177411732
N,N-diethyl-2-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide
CID 2575034
2-[(1S,3S,3aR,6aS)-5-benzyl-1-methyl-2',4,6-trioxospiro[1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3,3'-indole]-1'-yl]-N,N-diethylacetamide
CID 42583203
N-benzyl-N-ethyl-2-[(3S)-3-(3-fluorophenyl)-3-hydroxy-2-oxoindol-1-yl]acetamide
CID 95095383
N-(cyclopropylmethyl)-2-(3,3-dimethyl-2-oxoindol-1-yl)-N-methylacetamide
CID 95748634
N,N-diethyl-2-(2-oxo-4,5-dihydro-3H-1,4-benzodiazepin-1-yl)acetamide
CID 65362341
N,N-diethyl-2-[(4R)-4-methyl-2,5-dioxo-4-(2-phenylethyl)imidazolidin-1-yl]acetamide
CID 7170763
2-(2,5-dimethylpyrrol-1-yl)-N,N-diethylacetamide
CID 110688830
2-(2',5'-dioxospiro[2,4-dihydro-1H-naphthalene-3,4'-imidazolidine]-1'-yl)-N,N-diethylacetamide
CID 5162697
2-(7-amino-2,2-dimethyl-3-oxo-1,4-benzoxazin-4-yl)-N,N-diethylacetamide
CID 28815943
3-[(2E)-2-[(2Z,4Z)-5-ethoxypenta-2,4-dienylidene]-3,3-dimethylindol-1-yl]propanoic acid
CID 142081905

Frequently Asked Questions

What is the IUPAC name of 2-(3,3-dimethyl-2-methylideneindol-1-yl)-N,N-diethylacetamide?
The IUPAC name of 2-(3,3-dimethyl-2-methylideneindol-1-yl)-N,N-diethylacetamide (CID 58298824) is 2-(3,3-dimethyl-2-methylideneindol-1-yl)-N,N-diethylacetamide.
What is the SMILES notation for 2-(3,3-dimethyl-2-methylideneindol-1-yl)-N,N-diethylacetamide?
The canonical SMILES for 2-(3,3-dimethyl-2-methylideneindol-1-yl)-N,N-diethylacetamide is C=C1N(CC(=O)N(CC)CC)c2ccccc2C1(C)C.
What is the InChIKey of 2-(3,3-dimethyl-2-methylideneindol-1-yl)-N,N-diethylacetamide?
The InChIKey is MMMJNEBHKYMEFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O/c1-6-18(7-2)16(20)12-19-13(3)17(4,5)14-10-8-9-11-15(14)19/h8-11H,3,6-7,12H2,1-2,4-5H3.
What are the key properties of 2-(3,3-dimethyl-2-methylideneindol-1-yl)-N,N-diethylacetamide?
2-(3,3-dimethyl-2-methylideneindol-1-yl)-N,N-diethylacetamide has a molecular weight of 272.39 g/mol, XLogP of 3.17, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,3-dimethyl-2-methylideneindol-1-yl)-N,N-diethylacetamide is sourced from PubChem (CID 58298824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).