4-cyclopentyloxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide

C22H27NO2 — CID 39885058

IUPAC4-cyclopentyloxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide
SMILESCc1cccc(C(C)C)c1NC(=O)c1ccc(OC2CCCC2)cc1
InChIInChI=1S/C22H27NO2/c1-15(2)20-10-6-7-16(3)21(20)23-22(24)17-11-13-19(14-12-17)25-18-8-4-5-9-18/h6-7,10-15,18H,4-5,8-9H2,1-3H3,(H,23,24)
InChIKeyVYMZAPPZRROQTR-UHFFFAOYSA-N
MW337.46 g/mol
LogP5.69
Rot. Bonds5

About 4-cyclopentyloxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide

4-cyclopentyloxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide (PubChem CID 39885058) has the molecular formula C22H27NO2 and a molecular weight of 337.46 g/mol. Its IUPAC name is 4-cyclopentyloxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide.

Molecular Properties

Compound Name4-cyclopentyloxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide
PubChem CID39885058
Molecular FormulaC22H27NO2
Molecular Weight337.46 g/mol
Exact Mass337.20
IUPAC Name4-cyclopentyloxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide
SMILESCc1cccc(C(C)C)c1NC(=O)c1ccc(OC2CCCC2)cc1
InChIInChI=1S/C22H27NO2/c1-15(2)20-10-6-7-16(3)21(20)23-22(24)17-11-13-19(14-12-17)25-18-8-4-5-9-18/h6-7,10-15,18H,4-5,8-9H2,1-3H3,(H,23,24)
InChIKeyVYMZAPPZRROQTR-UHFFFAOYSA-N
XLogP5.69
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500337.46
LogP ≤ 55.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-cyclopentyloxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide 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

4-ethoxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide
CID 2701404
4-(cyclopropylsulfamoyl)-N-(2-methyl-6-propan-2-ylphenyl)benzamide
CID 109058403
4-(chloromethyl)-N-(2-methyl-6-propan-2-ylphenyl)benzamide
CID 43333467
N-(2-methyl-6-propan-2-ylphenyl)-4-pyrrolidin-1-ylsulfonylbenzamide
CID 2701412
N-(2-methyl-6-propan-2-ylphenyl)piperidine-2-carboxamide
CID 10730082
6-methyl-N-(2-methyl-6-propan-2-ylphenyl)pyridine-3-carboxamide
CID 18148418
2-N,5-N-bis(2-methyl-6-propan-2-ylphenyl)pyridine-2,5-dicarboxamide
CID 1312773
2-[(2-methyl-6-propan-2-ylphenyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 5061547
5-(cyclopentylamino)-N-(2-methyl-6-propan-2-ylphenyl)pyrazine-2-carboxamide
CID 109274174
N-[(3-hydroxycyclohexyl)methyl]-N'-(2-methyl-6-propan-2-ylphenyl)oxamide
CID 111490641
N-(4-cyclopentyloxyphenyl)-4-ethoxybenzamide
CID 36565370
4-cyclohexyloxy-N-(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)benzamide
CID 127885386

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyloxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide?
The IUPAC name of 4-cyclopentyloxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide (CID 39885058) is 4-cyclopentyloxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide.
What is the SMILES notation for 4-cyclopentyloxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide?
The canonical SMILES for 4-cyclopentyloxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide is Cc1cccc(C(C)C)c1NC(=O)c1ccc(OC2CCCC2)cc1.
What is the InChIKey of 4-cyclopentyloxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide?
The InChIKey is VYMZAPPZRROQTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27NO2/c1-15(2)20-10-6-7-16(3)21(20)23-22(24)17-11-13-19(14-12-17)25-18-8-4-5-9-18/h6-7,10-15,18H,4-5,8-9H2,1-3H3,(H,23,24).
What are the key properties of 4-cyclopentyloxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide?
4-cyclopentyloxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide has a molecular weight of 337.46 g/mol, XLogP of 5.69, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyloxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide is sourced from PubChem (CID 39885058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).