1-(5-methoxy-1H-indol-3-yl)-N-methyl-N-(2-pyridin-4-ylethyl)cyclopropane-1-carboxamide

C21H23N3O2 — CID 113210773

IUPAC1-(5-methoxy-1H-indol-3-yl)-N-methyl-N-(2-pyridin-4-ylethyl)cyclopropane-1-carboxamide
SMILESCOc1ccc2[nH]cc(C3(C(=O)N(C)CCc4ccncc4)CC3)c2c1
InChIInChI=1S/C21H23N3O2/c1-24(12-7-15-5-10-22-11-6-15)20(25)21(8-9-21)18-14-23-19-4-3-16(26-2)13-17(18)19/h3-6,10-11,13-14,23H,7-9,12H2,1-2H3
InChIKeyFTKQLKLUXRCIAA-UHFFFAOYSA-N
MW349.43 g/mol
LogP3.30
Rot. Bonds6

About 1-(5-methoxy-1H-indol-3-yl)-N-methyl-N-(2-pyridin-4-ylethyl)cyclopropane-1-carboxamide

1-(5-methoxy-1H-indol-3-yl)-N-methyl-N-(2-pyridin-4-ylethyl)cyclopropane-1-carboxamide (PubChem CID 113210773) has the molecular formula C21H23N3O2 and a molecular weight of 349.43 g/mol. Its IUPAC name is 1-(5-methoxy-1H-indol-3-yl)-N-methyl-N-(2-pyridin-4-ylethyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-(5-methoxy-1H-indol-3-yl)-N-methyl-N-(2-pyridin-4-ylethyl)cyclopropane-1-carboxamide
PubChem CID113210773
Molecular FormulaC21H23N3O2
Molecular Weight349.43 g/mol
Exact Mass349.18
IUPAC Name1-(5-methoxy-1H-indol-3-yl)-N-methyl-N-(2-pyridin-4-ylethyl)cyclopropane-1-carboxamide
SMILESCOc1ccc2[nH]cc(C3(C(=O)N(C)CCc4ccncc4)CC3)c2c1
InChIInChI=1S/C21H23N3O2/c1-24(12-7-15-5-10-22-11-6-15)20(25)21(8-9-21)18-14-23-19-4-3-16(26-2)13-17(18)19/h3-6,10-11,13-14,23H,7-9,12H2,1-2H3
InChIKeyFTKQLKLUXRCIAA-UHFFFAOYSA-N
XLogP3.30
TPSA58.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.43
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(5-methoxy-1H-indol-3-yl)-N-methyl-N-(2-pyridin-4-ylethyl)cyclopropane-1-carboxamide with MolForge

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Related Compounds

6-methoxy-N-methyl-N-(2-pyridin-4-ylethyl)-1H-indole-3-carboxamide
CID 113206552
N-ethyl-1-(5-methoxy-1H-indol-3-yl)-N-phenylcyclopropane-1-carboxamide
CID 113210822
N-[3-(dimethylamino)propyl]-1-(5-methoxy-1H-indol-3-yl)cyclopropane-1-carboxamide
CID 113210743
1-(5-methoxy-1H-indol-3-yl)-N-(pyridin-3-ylmethyl)cyclopropane-1-carboxamide
CID 113210764
1-(5-ethoxy-1H-indol-3-yl)cyclopropane-1-carboxylic acid
CID 82278313
N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-N-methylacetamide
CID 22367215
N-(2,5-dimethoxyphenyl)-1-(5-methoxy-1H-indol-3-yl)cyclopropane-1-carboxamide
CID 113210851
1-(5-methoxy-1H-indol-3-yl)-N-(5-methyl-1,2-oxazol-3-yl)cyclopropane-1-carboxamide
CID 113210901
4,5,6-trimethoxy-N-methyl-N-(2-pyridin-4-ylethyl)-1H-indole-3-carboxamide
CID 113206750
N-[2-(1H-indol-3-yl)ethyl]-1-(5-methoxy-1H-indol-3-yl)cyclopropane-1-carboxamide
CID 113210779
1-(1,3-benzodioxol-5-yl)-N-methyl-N-(2-pyridin-4-ylethyl)cyclopropane-1-carboxamide
CID 113198851
methyl 4-[[1-(5-methoxy-1H-indol-3-yl)cyclopropanecarbonyl]amino]benzoate
CID 113210863

Frequently Asked Questions

What is the IUPAC name of 1-(5-methoxy-1H-indol-3-yl)-N-methyl-N-(2-pyridin-4-ylethyl)cyclopropane-1-carboxamide?
The IUPAC name of 1-(5-methoxy-1H-indol-3-yl)-N-methyl-N-(2-pyridin-4-ylethyl)cyclopropane-1-carboxamide (CID 113210773) is 1-(5-methoxy-1H-indol-3-yl)-N-methyl-N-(2-pyridin-4-ylethyl)cyclopropane-1-carboxamide.
What is the SMILES notation for 1-(5-methoxy-1H-indol-3-yl)-N-methyl-N-(2-pyridin-4-ylethyl)cyclopropane-1-carboxamide?
The canonical SMILES for 1-(5-methoxy-1H-indol-3-yl)-N-methyl-N-(2-pyridin-4-ylethyl)cyclopropane-1-carboxamide is COc1ccc2[nH]cc(C3(C(=O)N(C)CCc4ccncc4)CC3)c2c1.
What is the InChIKey of 1-(5-methoxy-1H-indol-3-yl)-N-methyl-N-(2-pyridin-4-ylethyl)cyclopropane-1-carboxamide?
The InChIKey is FTKQLKLUXRCIAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N3O2/c1-24(12-7-15-5-10-22-11-6-15)20(25)21(8-9-21)18-14-23-19-4-3-16(26-2)13-17(18)19/h3-6,10-11,13-14,23H,7-9,12H2,1-2H3.
What are the key properties of 1-(5-methoxy-1H-indol-3-yl)-N-methyl-N-(2-pyridin-4-ylethyl)cyclopropane-1-carboxamide?
1-(5-methoxy-1H-indol-3-yl)-N-methyl-N-(2-pyridin-4-ylethyl)cyclopropane-1-carboxamide has a molecular weight of 349.43 g/mol, XLogP of 3.30, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methoxy-1H-indol-3-yl)-N-methyl-N-(2-pyridin-4-ylethyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 113210773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).