cyclopentyl N-[3-[(2-methoxyphenyl)methyl]-1-propylindol-5-yl]carbamate

C25H30N2O3 — CID 141017547

IUPACcyclopentyl N-[3-[(2-methoxyphenyl)methyl]-1-propylindol-5-yl]carbamate
SMILESCCCn1cc(Cc2ccccc2OC)c2cc(NC(=O)OC3CCCC3)ccc21
InChIInChI=1S/C25H30N2O3/c1-3-14-27-17-19(15-18-8-4-7-11-24(18)29-2)22-16-20(12-13-23(22)27)26-25(28)30-21-9-5-6-10-21/h4,7-8,11-13,16-17,21H,3,5-6,9-10,14-15H2,1-2H3,(H,26,28)
InChIKeyPQPVPYOGBQKGRC-UHFFFAOYSA-N
MW406.53 g/mol
LogP6.14
Rot. Bonds7

About cyclopentyl N-[3-[(2-methoxyphenyl)methyl]-1-propylindol-5-yl]carbamate

cyclopentyl N-[3-[(2-methoxyphenyl)methyl]-1-propylindol-5-yl]carbamate (PubChem CID 141017547) has the molecular formula C25H30N2O3 and a molecular weight of 406.53 g/mol. Its IUPAC name is cyclopentyl N-[3-[(2-methoxyphenyl)methyl]-1-propylindol-5-yl]carbamate.

Molecular Properties

Compound Namecyclopentyl N-[3-[(2-methoxyphenyl)methyl]-1-propylindol-5-yl]carbamate
PubChem CID141017547
Molecular FormulaC25H30N2O3
Molecular Weight406.53 g/mol
Exact Mass406.23
IUPAC Namecyclopentyl N-[3-[(2-methoxyphenyl)methyl]-1-propylindol-5-yl]carbamate
SMILESCCCn1cc(Cc2ccccc2OC)c2cc(NC(=O)OC3CCCC3)ccc21
InChIInChI=1S/C25H30N2O3/c1-3-14-27-17-19(15-18-8-4-7-11-24(18)29-2)22-16-20(12-13-23(22)27)26-25(28)30-21-9-5-6-10-21/h4,7-8,11-13,16-17,21H,3,5-6,9-10,14-15H2,1-2H3,(H,26,28)
InChIKeyPQPVPYOGBQKGRC-UHFFFAOYSA-N
XLogP6.14
TPSA52.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500406.53
LogP ≤ 56.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze cyclopentyl N-[3-[(2-methoxyphenyl)methyl]-1-propylindol-5-yl]carbamate 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

methyl 4-[[5-(cyclopentyloxycarbonylamino)-1-(2-methoxyethyl)indol-3-yl]methyl]-3-methoxybenzoate
CID 23365888
methyl 4-[[5-(cyclopentyloxycarbonylamino)-1-(3-methylbutyl)indol-3-yl]methyl]-3-methoxybenzoate
CID 23365903
sodium;4-[[5-(cyclopentyloxycarbonylamino)-1-methylindol-3-yl]methyl]-3-methoxybenzoic acid;hydride
CID 173223115
diphenylcarbamoyl 4-[[5-(cyclopentyloxycarbonylamino)-1-methylindol-3-yl]methyl]-3-methoxybenzoate
CID 86743327
methyl 4-[[5-(cyclopentyloxycarbonylamino)-1-[(4-fluorophenyl)carbamoyl]indol-3-yl]methyl]-3-methoxybenzoate
CID 54525687
4-[[5-(cyclopentyloxycarbonylamino)-1-(dimethylcarbamoyl)indol-3-yl]methyl]-3-methoxybenzoic acid
CID 54523791
potassium cyclopentyl N-[3-[[2-methoxy-4-[(2-methylphenyl)sulfonylcarbamoyl]phenyl]methyl]-1-methylindol-5-yl]carbamate
CID 11181062
calcium cyclopentyl N-[3-[[2-methoxy-4-[(2-methylphenyl)sulfonylcarbamoyl]phenyl]methyl]-1-methylindol-5-yl]carbamate
CID 23365845
sodium;cyclopentyl N-[3-[[2-methoxy-4-[(2-methylphenyl)sulfonylcarbamoyl]phenyl]methyl]-1-methylindol-5-yl]carbamate;hydride
CID 173138650
cyclopentyl N-[3-[[4-[cyclohexyl(cyclohexylcarbamoyl)carbamoyl]-2-methoxyphenyl]methyl]-1-(trideuteriomethyl)indol-5-yl]carbamate
CID 169447775
cyclopentyl N-[1-methyl-3-[[2-methyl-4-[(2-methylphenyl)sulfonylcarbamoyl]phenyl]methyl]indol-5-yl]carbamate
CID 123601293
[4-[2-[[4-[[5-(cyclopentyloxycarbonylamino)-1-methylindol-3-yl]methyl]-3-methoxybenzoyl]sulfamoyl]phenyl]-2-methylbut-3-yn-2-yl] acetate
CID 67884075

Frequently Asked Questions

What is the IUPAC name of cyclopentyl N-[3-[(2-methoxyphenyl)methyl]-1-propylindol-5-yl]carbamate?
The IUPAC name of cyclopentyl N-[3-[(2-methoxyphenyl)methyl]-1-propylindol-5-yl]carbamate (CID 141017547) is cyclopentyl N-[3-[(2-methoxyphenyl)methyl]-1-propylindol-5-yl]carbamate.
What is the SMILES notation for cyclopentyl N-[3-[(2-methoxyphenyl)methyl]-1-propylindol-5-yl]carbamate?
The canonical SMILES for cyclopentyl N-[3-[(2-methoxyphenyl)methyl]-1-propylindol-5-yl]carbamate is CCCn1cc(Cc2ccccc2OC)c2cc(NC(=O)OC3CCCC3)ccc21.
What is the InChIKey of cyclopentyl N-[3-[(2-methoxyphenyl)methyl]-1-propylindol-5-yl]carbamate?
The InChIKey is PQPVPYOGBQKGRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H30N2O3/c1-3-14-27-17-19(15-18-8-4-7-11-24(18)29-2)22-16-20(12-13-23(22)27)26-25(28)30-21-9-5-6-10-21/h4,7-8,11-13,16-17,21H,3,5-6,9-10,14-15H2,1-2H3,(H,26,28).
What are the key properties of cyclopentyl N-[3-[(2-methoxyphenyl)methyl]-1-propylindol-5-yl]carbamate?
cyclopentyl N-[3-[(2-methoxyphenyl)methyl]-1-propylindol-5-yl]carbamate has a molecular weight of 406.53 g/mol, XLogP of 6.14, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl N-[3-[(2-methoxyphenyl)methyl]-1-propylindol-5-yl]carbamate is sourced from PubChem (CID 141017547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).