N-[1-(4-cyclopentyloxybenzoyl)piperidin-4-yl]-3-phenylpropanamide

C26H32N2O3 — CID 55692214

IUPACN-[1-(4-cyclopentyloxybenzoyl)piperidin-4-yl]-3-phenylpropanamide
SMILESO=C(CCc1ccccc1)NC1CCN(C(=O)c2ccc(OC3CCCC3)cc2)CC1
InChIInChI=1S/C26H32N2O3/c29-25(15-10-20-6-2-1-3-7-20)27-22-16-18-28(19-17-22)26(30)21-11-13-24(14-12-21)31-23-8-4-5-9-23/h1-3,6-7,11-14,22-23H,4-5,8-10,15-19H2,(H,27,29)
InChIKeyXISAHPLEFFSNDW-UHFFFAOYSA-N
MW420.55 g/mol
LogP4.36
Rot. Bonds7

About N-[1-(4-cyclopentyloxybenzoyl)piperidin-4-yl]-3-phenylpropanamide

N-[1-(4-cyclopentyloxybenzoyl)piperidin-4-yl]-3-phenylpropanamide (PubChem CID 55692214) has the molecular formula C26H32N2O3 and a molecular weight of 420.55 g/mol. Its IUPAC name is N-[1-(4-cyclopentyloxybenzoyl)piperidin-4-yl]-3-phenylpropanamide.

Molecular Properties

Compound NameN-[1-(4-cyclopentyloxybenzoyl)piperidin-4-yl]-3-phenylpropanamide
PubChem CID55692214
Molecular FormulaC26H32N2O3
Molecular Weight420.55 g/mol
Exact Mass420.24
IUPAC NameN-[1-(4-cyclopentyloxybenzoyl)piperidin-4-yl]-3-phenylpropanamide
SMILESO=C(CCc1ccccc1)NC1CCN(C(=O)c2ccc(OC3CCCC3)cc2)CC1
InChIInChI=1S/C26H32N2O3/c29-25(15-10-20-6-2-1-3-7-20)27-22-16-18-28(19-17-22)26(30)21-11-13-24(14-12-21)31-23-8-4-5-9-23/h1-3,6-7,11-14,22-23H,4-5,8-10,15-19H2,(H,27,29)
InChIKeyXISAHPLEFFSNDW-UHFFFAOYSA-N
XLogP4.36
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.55
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-benzoylpiperidin-4-yl)-3-phenylpropanamide
CID 46464328
N-[1-[4-(oxolan-2-ylmethoxy)benzoyl]piperidin-4-yl]-3-phenylpropanamide
CID 46455343
3-(4-methylphenyl)-N-[1-(4-phenylbenzoyl)piperidin-4-yl]propanamide
CID 108556350
N-[1-(4-methoxybenzoyl)piperidin-4-yl]-2-phenylacetamide
CID 108551232
2-[4-(3-phenylpropanoylamino)piperidine-1-carbonyl]benzoic acid
CID 113083308
3-phenyl-N-[1-[5-(pyrrolidine-1-carbonyl)-1H-pyrrole-3-carbonyl]piperidin-4-yl]propanamide
CID 47056405
3-phenyl-N-[1-(3,4,5-trimethoxybenzoyl)piperidin-4-yl]propanamide
CID 108555415
[4-[1-(3-phenylpropyl)piperidin-4-yl]oxyphenyl]-pyrrolidin-1-ylmethanone
CID 24793060
2-phenyl-N-[1-(4-pyrrol-1-ylbenzoyl)piperidin-4-yl]acetamide
CID 108551296
methyl 1-[4-[1-(2-phenylethyl)piperidin-4-yl]oxybenzoyl]piperidine-4-carboxylate
CID 25385977
N-[1-[4-(4-chloro-3,5-dimethylpyrazol-1-yl)benzoyl]piperidin-4-yl]-3-phenylpropanamide
CID 46455348
ethyl [4-[4-[3-(3-methylphenyl)propanoylamino]piperidine-1-carbonyl]phenyl] carbonate
CID 108930457

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-cyclopentyloxybenzoyl)piperidin-4-yl]-3-phenylpropanamide?
The IUPAC name of N-[1-(4-cyclopentyloxybenzoyl)piperidin-4-yl]-3-phenylpropanamide (CID 55692214) is N-[1-(4-cyclopentyloxybenzoyl)piperidin-4-yl]-3-phenylpropanamide.
What is the SMILES notation for N-[1-(4-cyclopentyloxybenzoyl)piperidin-4-yl]-3-phenylpropanamide?
The canonical SMILES for N-[1-(4-cyclopentyloxybenzoyl)piperidin-4-yl]-3-phenylpropanamide is O=C(CCc1ccccc1)NC1CCN(C(=O)c2ccc(OC3CCCC3)cc2)CC1.
What is the InChIKey of N-[1-(4-cyclopentyloxybenzoyl)piperidin-4-yl]-3-phenylpropanamide?
The InChIKey is XISAHPLEFFSNDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H32N2O3/c29-25(15-10-20-6-2-1-3-7-20)27-22-16-18-28(19-17-22)26(30)21-11-13-24(14-12-21)31-23-8-4-5-9-23/h1-3,6-7,11-14,22-23H,4-5,8-10,15-19H2,(H,27,29).
What are the key properties of N-[1-(4-cyclopentyloxybenzoyl)piperidin-4-yl]-3-phenylpropanamide?
N-[1-(4-cyclopentyloxybenzoyl)piperidin-4-yl]-3-phenylpropanamide has a molecular weight of 420.55 g/mol, XLogP of 4.36, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-cyclopentyloxybenzoyl)piperidin-4-yl]-3-phenylpropanamide is sourced from PubChem (CID 55692214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).