N,N-diethyl-5-methoxy-1H-indole-3-carboxamide

C14H18N2O2 — CID 91755801

IUPACN,N-diethyl-5-methoxy-1H-indole-3-carboxamide
SMILESCCN(CC)C(=O)c1c[nH]c2ccc(OC)cc12
InChIInChI=1S/C14H18N2O2/c1-4-16(5-2)14(17)12-9-15-13-7-6-10(18-3)8-11(12)13/h6-9,15H,4-5H2,1-3H3
InChIKeyBNOWGBKOGNXCHD-UHFFFAOYSA-N
MW246.31 g/mol
LogP2.66
Rot. Bonds4

About N,N-diethyl-5-methoxy-1H-indole-3-carboxamide

N,N-diethyl-5-methoxy-1H-indole-3-carboxamide (PubChem CID 91755801) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is N,N-diethyl-5-methoxy-1H-indole-3-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-5-methoxy-1H-indole-3-carboxamide
PubChem CID91755801
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC NameN,N-diethyl-5-methoxy-1H-indole-3-carboxamide
SMILESCCN(CC)C(=O)c1c[nH]c2ccc(OC)cc12
InChIInChI=1S/C14H18N2O2/c1-4-16(5-2)14(17)12-9-15-13-7-6-10(18-3)8-11(12)13/h6-9,15H,4-5H2,1-3H3
InChIKeyBNOWGBKOGNXCHD-UHFFFAOYSA-N
XLogP2.66
TPSA45.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-methoxy-N,N-di(propan-2-yl)-1H-indole-3-carboxamide
CID 91757486
N,N-diethyl-2-(5-methoxy-1H-indol-3-yl)acetamide
CID 113209629
(5-methoxy-1H-indol-3-yl)-(4-methoxyphenyl)methanone
CID 43340483
N-benzyl-N-ethyl-6-methoxy-1H-indole-3-carboxamide
CID 113206541
2-(5-methoxy-1H-indol-3-yl)-2-oxoacetamide
CID 44719462
1-(5-methoxy-1H-indol-3-yl)nonan-1-one
CID 65448551
2-(5-methoxy-1H-indol-3-yl)-2-oxoacetaldehyde
CID 50901388
methyl 2-[(5-amino-1H-indole-3-carbonyl)-ethylamino]acetate
CID 63116714
4-chloro-1-(5-methoxy-1H-indol-3-yl)butan-1-one
CID 21469454
(5-methoxy-1H-indol-3-yl)-(3-methoxythiophen-2-yl)methanone
CID 81127463
5-amino-N-ethyl-N-(2-hydroxy-2-methylpropyl)-1H-indole-3-carboxamide
CID 79383870
N-[2-(5-methoxy-1H-indol-3-yl)-2-oxoethyl]hexanamide
CID 142044574

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-5-methoxy-1H-indole-3-carboxamide?
The IUPAC name of N,N-diethyl-5-methoxy-1H-indole-3-carboxamide (CID 91755801) is N,N-diethyl-5-methoxy-1H-indole-3-carboxamide.
What is the SMILES notation for N,N-diethyl-5-methoxy-1H-indole-3-carboxamide?
The canonical SMILES for N,N-diethyl-5-methoxy-1H-indole-3-carboxamide is CCN(CC)C(=O)c1c[nH]c2ccc(OC)cc12.
What is the InChIKey of N,N-diethyl-5-methoxy-1H-indole-3-carboxamide?
The InChIKey is BNOWGBKOGNXCHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2/c1-4-16(5-2)14(17)12-9-15-13-7-6-10(18-3)8-11(12)13/h6-9,15H,4-5H2,1-3H3.
What are the key properties of N,N-diethyl-5-methoxy-1H-indole-3-carboxamide?
N,N-diethyl-5-methoxy-1H-indole-3-carboxamide has a molecular weight of 246.31 g/mol, XLogP of 2.66, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-5-methoxy-1H-indole-3-carboxamide is sourced from PubChem (CID 91755801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).