N-(2-amino-2-oxoethyl)-N-ethyl-1H-indole-2-carboxamide

C13H15N3O2 — CID 103103798

IUPACN-(2-amino-2-oxoethyl)-N-ethyl-1H-indole-2-carboxamide
SMILESCCN(CC(N)=O)C(=O)c1cc2ccccc2[nH]1
InChIInChI=1S/C13H15N3O2/c1-2-16(8-12(14)17)13(18)11-7-9-5-3-4-6-10(9)15-11/h3-7,15H,2,8H2,1H3,(H2,14,17)
InChIKeyKUAZACKGDDSTSK-UHFFFAOYSA-N
MW245.28 g/mol
LogP1.12
Rot. Bonds4

About N-(2-amino-2-oxoethyl)-N-ethyl-1H-indole-2-carboxamide

N-(2-amino-2-oxoethyl)-N-ethyl-1H-indole-2-carboxamide (PubChem CID 103103798) has the molecular formula C13H15N3O2 and a molecular weight of 245.28 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-N-ethyl-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)-N-ethyl-1H-indole-2-carboxamide
PubChem CID103103798
Molecular FormulaC13H15N3O2
Molecular Weight245.28 g/mol
Exact Mass245.12
IUPAC NameN-(2-amino-2-oxoethyl)-N-ethyl-1H-indole-2-carboxamide
SMILESCCN(CC(N)=O)C(=O)c1cc2ccccc2[nH]1
InChIInChI=1S/C13H15N3O2/c1-2-16(8-12(14)17)13(18)11-7-9-5-3-4-6-10(9)15-11/h3-7,15H,2,8H2,1H3,(H2,14,17)
InChIKeyKUAZACKGDDSTSK-UHFFFAOYSA-N
XLogP1.12
TPSA79.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-N-(2-methylpropyl)-1H-indole-2-carboxamide
CID 43421005
N-ethyl-N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide
CID 33032265
N-ethyl-N-methyl-1H-indole-2-carboxamide
CID 43421002
N-ethyl-N-[(3-fluorophenyl)methyl]-1H-indole-2-carboxamide
CID 51190000
N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-1H-indole-2-carboxamide
CID 25313237
2-[2-(dimethylamino)ethyl-(1H-indole-2-carbonyl)amino]acetic acid
CID 107424007
N-ethyl-N-phenyl-1H-indole-2-carboxamide
CID 43398536
2-[ethyl-(6-methyl-1H-indole-2-carbonyl)amino]acetic acid
CID 119205851
N-ethyl-N-[(4-oxo-3H-quinazolin-2-yl)methyl]-1H-indole-2-carboxamide
CID 135821179
2-[1H-indole-2-carbonyl(prop-2-enyl)amino]acetic acid
CID 79262806
5-amino-N-ethyl-N-[2-(methylamino)-2-oxoethyl]-1H-indole-2-carboxamide
CID 63117755
ethane;ethyl 1H-indole-2-carboxylate
CID 91376411

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethyl)-N-ethyl-1H-indole-2-carboxamide?
The IUPAC name of N-(2-amino-2-oxoethyl)-N-ethyl-1H-indole-2-carboxamide (CID 103103798) is N-(2-amino-2-oxoethyl)-N-ethyl-1H-indole-2-carboxamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-N-ethyl-1H-indole-2-carboxamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)-N-ethyl-1H-indole-2-carboxamide is CCN(CC(N)=O)C(=O)c1cc2ccccc2[nH]1.
What is the InChIKey of N-(2-amino-2-oxoethyl)-N-ethyl-1H-indole-2-carboxamide?
The InChIKey is KUAZACKGDDSTSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2/c1-2-16(8-12(14)17)13(18)11-7-9-5-3-4-6-10(9)15-11/h3-7,15H,2,8H2,1H3,(H2,14,17).
What are the key properties of N-(2-amino-2-oxoethyl)-N-ethyl-1H-indole-2-carboxamide?
N-(2-amino-2-oxoethyl)-N-ethyl-1H-indole-2-carboxamide has a molecular weight of 245.28 g/mol, XLogP of 1.12, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethyl)-N-ethyl-1H-indole-2-carboxamide is sourced from PubChem (CID 103103798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).