4-ethyl-N,N-dimethyl-1H-indole-2-carboxamide

C13H16N2O — CID 176933500

IUPAC4-ethyl-N,N-dimethyl-1H-indole-2-carboxamide
SMILESCCc1cccc2[nH]c(C(=O)N(C)C)cc12
InChIInChI=1S/C13H16N2O/c1-4-9-6-5-7-11-10(9)8-12(14-11)13(16)15(2)3/h5-8,14H,4H2,1-3H3
InChIKeyKCHUHKQLXFQQDO-UHFFFAOYSA-N
MW216.28 g/mol
LogP2.43
Rot. Bonds2

About 4-ethyl-N,N-dimethyl-1H-indole-2-carboxamide

4-ethyl-N,N-dimethyl-1H-indole-2-carboxamide (PubChem CID 176933500) has the molecular formula C13H16N2O and a molecular weight of 216.28 g/mol. Its IUPAC name is 4-ethyl-N,N-dimethyl-1H-indole-2-carboxamide.

Molecular Properties

Compound Name4-ethyl-N,N-dimethyl-1H-indole-2-carboxamide
PubChem CID176933500
Molecular FormulaC13H16N2O
Molecular Weight216.28 g/mol
Exact Mass216.13
IUPAC Name4-ethyl-N,N-dimethyl-1H-indole-2-carboxamide
SMILESCCc1cccc2[nH]c(C(=O)N(C)C)cc12
InChIInChI=1S/C13H16N2O/c1-4-9-6-5-7-11-10(9)8-12(14-11)13(16)15(2)3/h5-8,14H,4H2,1-3H3
InChIKeyKCHUHKQLXFQQDO-UHFFFAOYSA-N
XLogP2.43
TPSA36.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-bromo-N,N-dimethyl-1H-indole-2-carboxamide
CID 66897930
N,N-dimethyl-4-oxo-1H-quinoline-2-carboxamide
CID 47120436
4-(aminomethyl)-N-carbamimidoyl-N-methyl-1H-indole-2-carboxamide
CID 54304465
N-[(5-bromo-2-fluorophenyl)methyl]-4-fluoro-N-methyl-1H-indole-2-carboxamide
CID 55580692
4-fluoro-N-(1-hydroxypropan-2-yl)-N-methyl-1H-indole-2-carboxamide
CID 109388525
N-[(2-hydroxyphenyl)methyl]-N-methyl-3H-benzo[e]indole-2-carboxamide
CID 71891274
N-ethyl-N-methyl-1H-indole-2-carboxamide
CID 43421002
3-[(4-fluoro-1H-indole-2-carbonyl)-methylamino]-2-methylpropanoic acid
CID 119228216
N-cyclopropyl-4-fluoro-N-[(2-fluorophenyl)methyl]-1H-indole-2-carboxamide
CID 36746307
N-[(4-ethoxyphenyl)methyl]-4-fluoro-N-methyl-1H-indole-2-carboxamide
CID 36711727
N-carbamimidoyl-N,4-dimethyl-1H-indole-2-carboxamide
CID 54567133
4-fluoro-N-methyl-N-[(4-methylsulfanylphenyl)methyl]-1H-indole-2-carboxamide
CID 36704751

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N,N-dimethyl-1H-indole-2-carboxamide?
The IUPAC name of 4-ethyl-N,N-dimethyl-1H-indole-2-carboxamide (CID 176933500) is 4-ethyl-N,N-dimethyl-1H-indole-2-carboxamide.
What is the SMILES notation for 4-ethyl-N,N-dimethyl-1H-indole-2-carboxamide?
The canonical SMILES for 4-ethyl-N,N-dimethyl-1H-indole-2-carboxamide is CCc1cccc2[nH]c(C(=O)N(C)C)cc12.
What is the InChIKey of 4-ethyl-N,N-dimethyl-1H-indole-2-carboxamide?
The InChIKey is KCHUHKQLXFQQDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O/c1-4-9-6-5-7-11-10(9)8-12(14-11)13(16)15(2)3/h5-8,14H,4H2,1-3H3.
What are the key properties of 4-ethyl-N,N-dimethyl-1H-indole-2-carboxamide?
4-ethyl-N,N-dimethyl-1H-indole-2-carboxamide has a molecular weight of 216.28 g/mol, XLogP of 2.43, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N,N-dimethyl-1H-indole-2-carboxamide is sourced from PubChem (CID 176933500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).