1-ethyl-N-[2-(2-methoxyethylamino)-2-oxoethyl]indole-2-carboxamide

C16H21N3O3 — CID 60550859

IUPAC1-ethyl-N-[2-(2-methoxyethylamino)-2-oxoethyl]indole-2-carboxamide
SMILESCCn1c(C(=O)NCC(=O)NCCOC)cc2ccccc21
InChIInChI=1S/C16H21N3O3/c1-3-19-13-7-5-4-6-12(13)10-14(19)16(21)18-11-15(20)17-8-9-22-2/h4-7,10H,3,8-9,11H2,1-2H3,(H,17,20)(H,18,21)
InChIKeyUJNUICMPNYOZFX-UHFFFAOYSA-N
MW303.36 g/mol
LogP1.15
Rot. Bonds7

About 1-ethyl-N-[2-(2-methoxyethylamino)-2-oxoethyl]indole-2-carboxamide

1-ethyl-N-[2-(2-methoxyethylamino)-2-oxoethyl]indole-2-carboxamide (PubChem CID 60550859) has the molecular formula C16H21N3O3 and a molecular weight of 303.36 g/mol. Its IUPAC name is 1-ethyl-N-[2-(2-methoxyethylamino)-2-oxoethyl]indole-2-carboxamide.

Molecular Properties

Compound Name1-ethyl-N-[2-(2-methoxyethylamino)-2-oxoethyl]indole-2-carboxamide
PubChem CID60550859
Molecular FormulaC16H21N3O3
Molecular Weight303.36 g/mol
Exact Mass303.16
IUPAC Name1-ethyl-N-[2-(2-methoxyethylamino)-2-oxoethyl]indole-2-carboxamide
SMILESCCn1c(C(=O)NCC(=O)NCCOC)cc2ccccc21
InChIInChI=1S/C16H21N3O3/c1-3-19-13-7-5-4-6-12(13)10-14(19)16(21)18-11-15(20)17-8-9-22-2/h4-7,10H,3,8-9,11H2,1-2H3,(H,17,20)(H,18,21)
InChIKeyUJNUICMPNYOZFX-UHFFFAOYSA-N
XLogP1.15
TPSA72.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.36
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

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CID 166595239
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1-ethyl-N-[(2S)-2-hydroxy-2-(4-methoxyphenyl)ethyl]indole-2-carboxamide
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N-[2-[4-(difluoromethoxy)phenyl]ethyl]-1-ethylindole-2-carboxamide
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methyl 2-[(1-ethylindole-2-carbonyl)amino]-4-methylpentanoate
CID 60550495
N-[2-(1-ethylbenzimidazol-2-yl)ethyl]-2-(2-methoxyethylamino)acetamide;dihydrochloride
CID 119866339
1-ethyl-N-[[1-(1-hydroxy-2-methylpropyl)cyclopropyl]methyl]indole-2-carboxamide
CID 75444716
N-(2-methoxyethyl)-2-[(2-naphthalen-2-yloxyacetyl)amino]acetamide
CID 24517119
2-methoxy-N-[2-(2-methoxyethylamino)-2-oxoethyl]benzamide
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CID 35811048

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-[2-(2-methoxyethylamino)-2-oxoethyl]indole-2-carboxamide?
The IUPAC name of 1-ethyl-N-[2-(2-methoxyethylamino)-2-oxoethyl]indole-2-carboxamide (CID 60550859) is 1-ethyl-N-[2-(2-methoxyethylamino)-2-oxoethyl]indole-2-carboxamide.
What is the SMILES notation for 1-ethyl-N-[2-(2-methoxyethylamino)-2-oxoethyl]indole-2-carboxamide?
The canonical SMILES for 1-ethyl-N-[2-(2-methoxyethylamino)-2-oxoethyl]indole-2-carboxamide is CCn1c(C(=O)NCC(=O)NCCOC)cc2ccccc21.
What is the InChIKey of 1-ethyl-N-[2-(2-methoxyethylamino)-2-oxoethyl]indole-2-carboxamide?
The InChIKey is UJNUICMPNYOZFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O3/c1-3-19-13-7-5-4-6-12(13)10-14(19)16(21)18-11-15(20)17-8-9-22-2/h4-7,10H,3,8-9,11H2,1-2H3,(H,17,20)(H,18,21).
What are the key properties of 1-ethyl-N-[2-(2-methoxyethylamino)-2-oxoethyl]indole-2-carboxamide?
1-ethyl-N-[2-(2-methoxyethylamino)-2-oxoethyl]indole-2-carboxamide has a molecular weight of 303.36 g/mol, XLogP of 1.15, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-[2-(2-methoxyethylamino)-2-oxoethyl]indole-2-carboxamide is sourced from PubChem (CID 60550859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).