N,N-diethyl-4-methoxy-2-methyl-1H-indole-3-carboxamide

C15H20N2O2 — CID 110855129

IUPACN,N-diethyl-4-methoxy-2-methyl-1H-indole-3-carboxamide
SMILESCCN(CC)C(=O)c1c(C)[nH]c2cccc(OC)c12
InChIInChI=1S/C15H20N2O2/c1-5-17(6-2)15(18)13-10(3)16-11-8-7-9-12(19-4)14(11)13/h7-9,16H,5-6H2,1-4H3
InChIKeyHGTPRQVNLHJMER-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.97
Rot. Bonds4

About N,N-diethyl-4-methoxy-2-methyl-1H-indole-3-carboxamide

N,N-diethyl-4-methoxy-2-methyl-1H-indole-3-carboxamide (PubChem CID 110855129) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is N,N-diethyl-4-methoxy-2-methyl-1H-indole-3-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-4-methoxy-2-methyl-1H-indole-3-carboxamide
PubChem CID110855129
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC NameN,N-diethyl-4-methoxy-2-methyl-1H-indole-3-carboxamide
SMILESCCN(CC)C(=O)c1c(C)[nH]c2cccc(OC)c12
InChIInChI=1S/C15H20N2O2/c1-5-17(6-2)15(18)13-10(3)16-11-8-7-9-12(19-4)14(11)13/h7-9,16H,5-6H2,1-4H3
InChIKeyHGTPRQVNLHJMER-UHFFFAOYSA-N
XLogP2.97
TPSA45.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

bis(4-methoxy-2-methyl-1H-indol-3-yl)methanone
CID 143294111
4-chloro-N,N-diethyl-2-methyl-1H-indole-3-carboxamide
CID 110855128
1-(4-methoxy-2-methyl-1H-indol-3-yl)-2-methylpropan-1-one
CID 82279193
(E)-3-(4-methoxy-2-methyl-1H-indol-3-yl)but-2-enoic acid
CID 82279144
5-methoxy-2,3-dimethyl-1H-quinolin-4-one
CID 119083522
N-cyclopentyl-4-methoxy-2-methyl-1H-indole-3-carboxamide
CID 110848681
2-acetyl-N,N-diethyl-3-methoxybenzamide
CID 19802545
2-(4-ethoxy-2-methyl-1H-indol-3-yl)-2-oxoacetamide
CID 59170340
ethyl 3-formyl-4-methoxy-1H-indole-2-carboxylate
CID 154727990
3,4-dihydro-1H-isoquinolin-2-yl-(4-methoxy-2-methyl-1H-indol-3-yl)methanone
CID 110852347
N,N-diethyl-2,7-dimethyl-1H-indole-3-carboxamide
CID 110855138
N-(3-aminopropyl)-N-ethyl-2-fluoro-6-methoxybenzamide
CID 65434746

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-4-methoxy-2-methyl-1H-indole-3-carboxamide?
The IUPAC name of N,N-diethyl-4-methoxy-2-methyl-1H-indole-3-carboxamide (CID 110855129) is N,N-diethyl-4-methoxy-2-methyl-1H-indole-3-carboxamide.
What is the SMILES notation for N,N-diethyl-4-methoxy-2-methyl-1H-indole-3-carboxamide?
The canonical SMILES for N,N-diethyl-4-methoxy-2-methyl-1H-indole-3-carboxamide is CCN(CC)C(=O)c1c(C)[nH]c2cccc(OC)c12.
What is the InChIKey of N,N-diethyl-4-methoxy-2-methyl-1H-indole-3-carboxamide?
The InChIKey is HGTPRQVNLHJMER-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-5-17(6-2)15(18)13-10(3)16-11-8-7-9-12(19-4)14(11)13/h7-9,16H,5-6H2,1-4H3.
What are the key properties of N,N-diethyl-4-methoxy-2-methyl-1H-indole-3-carboxamide?
N,N-diethyl-4-methoxy-2-methyl-1H-indole-3-carboxamide has a molecular weight of 260.34 g/mol, XLogP of 2.97, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-4-methoxy-2-methyl-1H-indole-3-carboxamide is sourced from PubChem (CID 110855129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).