N-ethyl-2-(1H-indol-4-ylmethylamino)-N-methylacetamide

C14H19N3O — CID 104923370

IUPACN-ethyl-2-(1H-indol-4-ylmethylamino)-N-methylacetamide
SMILESCCN(C)C(=O)CNCc1cccc2[nH]ccc12
InChIInChI=1S/C14H19N3O/c1-3-17(2)14(18)10-15-9-11-5-4-6-13-12(11)7-8-16-13/h4-8,15-16H,3,9-10H2,1-2H3
InChIKeyUCETWCPEFVSVKB-UHFFFAOYSA-N
MW245.33 g/mol
LogP1.74
Rot. Bonds5

About N-ethyl-2-(1H-indol-4-ylmethylamino)-N-methylacetamide

N-ethyl-2-(1H-indol-4-ylmethylamino)-N-methylacetamide (PubChem CID 104923370) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is N-ethyl-2-(1H-indol-4-ylmethylamino)-N-methylacetamide.

Molecular Properties

Compound NameN-ethyl-2-(1H-indol-4-ylmethylamino)-N-methylacetamide
PubChem CID104923370
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC NameN-ethyl-2-(1H-indol-4-ylmethylamino)-N-methylacetamide
SMILESCCN(C)C(=O)CNCc1cccc2[nH]ccc12
InChIInChI=1S/C14H19N3O/c1-3-17(2)14(18)10-15-9-11-5-4-6-13-12(11)7-8-16-13/h4-8,15-16H,3,9-10H2,1-2H3
InChIKeyUCETWCPEFVSVKB-UHFFFAOYSA-N
XLogP1.74
TPSA48.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(2,3-dihydroxyphenyl)methylamino]-N-ethyl-N-methylacetamide
CID 114132352
N-[2-[ethyl(methyl)amino]-2-oxoethyl]-2-(1H-indol-3-yl)acetamide
CID 104920242
N-(1H-indol-4-ylmethyl)propanamide
CID 176935116
N,N-diethyl-4-[(1H-indol-4-ylmethylamino)methyl]benzamide
CID 119109918
(E)-4-(dimethylamino)-N-ethyl-N-(1H-indol-4-ylmethyl)but-2-enamide
CID 146098281
2-[(2-chlorophenyl)methylamino]-N-ethyl-N-methylacetamide
CID 43309591
1-[3-(dimethylamino)propyl]-3-(1H-indol-4-ylmethyl)-1-methylurea
CID 121496080
N-(1H-indol-4-ylmethyl)-2-methylpropan-1-amine
CID 17221020
N-cyclopropyl-2-(1H-indol-4-ylmethylamino)acetamide
CID 63000574
2-(1H-indol-4-ylmethylamino)ethanol
CID 53269747
N-ethyl-2-[(2-fluoro-3-methoxyphenyl)methylamino]-N-methylacetamide
CID 114132777
3-(1H-indol-4-ylmethylamino)-N-propan-2-ylpropanamide
CID 112688766

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(1H-indol-4-ylmethylamino)-N-methylacetamide?
The IUPAC name of N-ethyl-2-(1H-indol-4-ylmethylamino)-N-methylacetamide (CID 104923370) is N-ethyl-2-(1H-indol-4-ylmethylamino)-N-methylacetamide.
What is the SMILES notation for N-ethyl-2-(1H-indol-4-ylmethylamino)-N-methylacetamide?
The canonical SMILES for N-ethyl-2-(1H-indol-4-ylmethylamino)-N-methylacetamide is CCN(C)C(=O)CNCc1cccc2[nH]ccc12.
What is the InChIKey of N-ethyl-2-(1H-indol-4-ylmethylamino)-N-methylacetamide?
The InChIKey is UCETWCPEFVSVKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O/c1-3-17(2)14(18)10-15-9-11-5-4-6-13-12(11)7-8-16-13/h4-8,15-16H,3,9-10H2,1-2H3.
What are the key properties of N-ethyl-2-(1H-indol-4-ylmethylamino)-N-methylacetamide?
N-ethyl-2-(1H-indol-4-ylmethylamino)-N-methylacetamide has a molecular weight of 245.33 g/mol, XLogP of 1.74, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(1H-indol-4-ylmethylamino)-N-methylacetamide is sourced from PubChem (CID 104923370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).