4-phenylmethoxy-N-(2-piperidin-1-ylethyl)-1-propylindole-2-carboxamide

C26H33N3O2 — CID 42804025

IUPAC4-phenylmethoxy-N-(2-piperidin-1-ylethyl)-1-propylindole-2-carboxamide
SMILESCCCn1c(C(=O)NCCN2CCCCC2)cc2c(OCc3ccccc3)cccc21
InChIInChI=1S/C26H33N3O2/c1-2-15-29-23-12-9-13-25(31-20-21-10-5-3-6-11-21)22(23)19-24(29)26(30)27-14-18-28-16-7-4-8-17-28/h3,5-6,9-13,19H,2,4,7-8,14-18,20H2,1H3,(H,27,30)
InChIKeyXFDPIXCTCVKQKG-UHFFFAOYSA-N
MW419.57 g/mol
LogP4.85
Rot. Bonds9

About 4-phenylmethoxy-N-(2-piperidin-1-ylethyl)-1-propylindole-2-carboxamide

4-phenylmethoxy-N-(2-piperidin-1-ylethyl)-1-propylindole-2-carboxamide (PubChem CID 42804025) has the molecular formula C26H33N3O2 and a molecular weight of 419.57 g/mol. Its IUPAC name is 4-phenylmethoxy-N-(2-piperidin-1-ylethyl)-1-propylindole-2-carboxamide.

Molecular Properties

Compound Name4-phenylmethoxy-N-(2-piperidin-1-ylethyl)-1-propylindole-2-carboxamide
PubChem CID42804025
Molecular FormulaC26H33N3O2
Molecular Weight419.57 g/mol
Exact Mass419.26
IUPAC Name4-phenylmethoxy-N-(2-piperidin-1-ylethyl)-1-propylindole-2-carboxamide
SMILESCCCn1c(C(=O)NCCN2CCCCC2)cc2c(OCc3ccccc3)cccc21
InChIInChI=1S/C26H33N3O2/c1-2-15-29-23-12-9-13-25(31-20-21-10-5-3-6-11-21)22(23)19-24(29)26(30)27-14-18-28-16-7-4-8-17-28/h3,5-6,9-13,19H,2,4,7-8,14-18,20H2,1H3,(H,27,30)
InChIKeyXFDPIXCTCVKQKG-UHFFFAOYSA-N
XLogP4.85
TPSA46.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500419.57
LogP ≤ 54.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-phenylmethoxy-N-(2-piperidin-1-ylethyl)-1-propylindole-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-benzyl-N-hexyl-4-phenylmethoxyindole-2-carboxamide
CID 42804017
(4-methylpiperidin-1-yl)-(4-phenylmethoxy-1-propylindol-2-yl)methanone
CID 42666955
1-[(4-methylphenyl)methyl]-4-prop-2-enoxy-N-(2-pyrrolidin-1-ylethyl)indole-2-carboxamide
CID 42807246
N-cyclohexyl-4-[(2-fluorophenyl)methoxy]-1-propylindole-2-carboxamide
CID 42803998
2,5-bis(phenylmethoxy)-N-(2-piperidin-1-ylethyl)benzamide
CID 139616736
1-(2-methoxyethyl)-4-phenylmethoxy-N-(pyridin-2-ylmethyl)indole-2-carboxamide
CID 42667450
N-cyclopropyl-1-(2-methylpropyl)-4-phenylmethoxyindole-2-carboxamide
CID 42807240
4-[(2-fluorophenyl)methoxy]-N-(4-methylphenyl)-1-propylindole-2-carboxamide
CID 42803999
1-ethyl-4-hydroxy-2-oxo-N-(3-piperidin-1-ylpropyl)quinoline-3-carboxamide
CID 54683762
2-phenyl-N-(2-pyrrolidin-1-ylethyl)acetamide
CID 975347
2-hydroxy-3-methoxy-N-(2-pyrrolidin-1-ylethyl)benzamide
CID 60682639
6-(3-phenylpropyl)-N-(2-pyrrolidin-1-ylethyl)thieno[2,3-b]pyrrole-5-carboxamide
CID 7215376

Frequently Asked Questions

What is the IUPAC name of 4-phenylmethoxy-N-(2-piperidin-1-ylethyl)-1-propylindole-2-carboxamide?
The IUPAC name of 4-phenylmethoxy-N-(2-piperidin-1-ylethyl)-1-propylindole-2-carboxamide (CID 42804025) is 4-phenylmethoxy-N-(2-piperidin-1-ylethyl)-1-propylindole-2-carboxamide.
What is the SMILES notation for 4-phenylmethoxy-N-(2-piperidin-1-ylethyl)-1-propylindole-2-carboxamide?
The canonical SMILES for 4-phenylmethoxy-N-(2-piperidin-1-ylethyl)-1-propylindole-2-carboxamide is CCCn1c(C(=O)NCCN2CCCCC2)cc2c(OCc3ccccc3)cccc21.
What is the InChIKey of 4-phenylmethoxy-N-(2-piperidin-1-ylethyl)-1-propylindole-2-carboxamide?
The InChIKey is XFDPIXCTCVKQKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H33N3O2/c1-2-15-29-23-12-9-13-25(31-20-21-10-5-3-6-11-21)22(23)19-24(29)26(30)27-14-18-28-16-7-4-8-17-28/h3,5-6,9-13,19H,2,4,7-8,14-18,20H2,1H3,(H,27,30).
What are the key properties of 4-phenylmethoxy-N-(2-piperidin-1-ylethyl)-1-propylindole-2-carboxamide?
4-phenylmethoxy-N-(2-piperidin-1-ylethyl)-1-propylindole-2-carboxamide has a molecular weight of 419.57 g/mol, XLogP of 4.85, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenylmethoxy-N-(2-piperidin-1-ylethyl)-1-propylindole-2-carboxamide is sourced from PubChem (CID 42804025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).