N-[(4-morpholin-4-ylphenyl)methyl]-1-phenylcyclopentane-1-carboxamide

C23H28N2O2 — CID 56922098

IUPACN-[(4-morpholin-4-ylphenyl)methyl]-1-phenylcyclopentane-1-carboxamide
SMILESO=C(NCc1ccc(N2CCOCC2)cc1)C1(c2ccccc2)CCCC1
InChIInChI=1S/C23H28N2O2/c26-22(23(12-4-5-13-23)20-6-2-1-3-7-20)24-18-19-8-10-21(11-9-19)25-14-16-27-17-15-25/h1-3,6-11H,4-5,12-18H2,(H,24,26)
InChIKeyGOWLCUBZJCXJFI-UHFFFAOYSA-N
MW364.49 g/mol
LogP3.65
Rot. Bonds5

About N-[(4-morpholin-4-ylphenyl)methyl]-1-phenylcyclopentane-1-carboxamide

N-[(4-morpholin-4-ylphenyl)methyl]-1-phenylcyclopentane-1-carboxamide (PubChem CID 56922098) has the molecular formula C23H28N2O2 and a molecular weight of 364.49 g/mol. Its IUPAC name is N-[(4-morpholin-4-ylphenyl)methyl]-1-phenylcyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-[(4-morpholin-4-ylphenyl)methyl]-1-phenylcyclopentane-1-carboxamide
PubChem CID56922098
Molecular FormulaC23H28N2O2
Molecular Weight364.49 g/mol
Exact Mass364.22
IUPAC NameN-[(4-morpholin-4-ylphenyl)methyl]-1-phenylcyclopentane-1-carboxamide
SMILESO=C(NCc1ccc(N2CCOCC2)cc1)C1(c2ccccc2)CCCC1
InChIInChI=1S/C23H28N2O2/c26-22(23(12-4-5-13-23)20-6-2-1-3-7-20)24-18-19-8-10-21(11-9-19)25-14-16-27-17-15-25/h1-3,6-11H,4-5,12-18H2,(H,24,26)
InChIKeyGOWLCUBZJCXJFI-UHFFFAOYSA-N
XLogP3.65
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.49
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

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Related Compounds

N-[(4-morpholin-4-ylphenyl)methyl]-4-phenyloxane-4-carboxamide
CID 56922873
1-(3,5-dimethylphenyl)-N-[(4-morpholin-4-ylphenyl)methyl]cyclobutane-1-carboxamide
CID 75417030
4-[[(1-phenylcyclohexanecarbonyl)amino]methyl]benzoic acid
CID 134561755
N-[[4-(azepan-1-ylmethyl)phenyl]methyl]-4-phenyloxane-4-carboxamide
CID 47085199
N-[(4-chlorophenyl)methyl]-1-phenylcyclopentane-1-carboxamide
CID 35571496
4-(3,5-dimethylphenyl)-N-[(4-piperidin-1-ylphenyl)methyl]oxane-4-carboxamide
CID 46951727
CID 159321195
CID 159321195
N-[[4-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]-1-phenylcyclopentane-1-carboxamide
CID 56922153
N'-benzyl-N-[2-(4-morpholin-4-ylphenyl)ethyl]oxamide
CID 16891636
(4-morpholin-4-ylphenyl)methylurea
CID 142276122
N-ethyl-1-phenylcyclopentane-1-carboxamide
CID 778764
N-[[1-(morpholin-4-ylmethyl)cyclohexyl]methyl]-1-phenylcyclopropane-1-carboxamide
CID 126790169

Frequently Asked Questions

What is the IUPAC name of N-[(4-morpholin-4-ylphenyl)methyl]-1-phenylcyclopentane-1-carboxamide?
The IUPAC name of N-[(4-morpholin-4-ylphenyl)methyl]-1-phenylcyclopentane-1-carboxamide (CID 56922098) is N-[(4-morpholin-4-ylphenyl)methyl]-1-phenylcyclopentane-1-carboxamide.
What is the SMILES notation for N-[(4-morpholin-4-ylphenyl)methyl]-1-phenylcyclopentane-1-carboxamide?
The canonical SMILES for N-[(4-morpholin-4-ylphenyl)methyl]-1-phenylcyclopentane-1-carboxamide is O=C(NCc1ccc(N2CCOCC2)cc1)C1(c2ccccc2)CCCC1.
What is the InChIKey of N-[(4-morpholin-4-ylphenyl)methyl]-1-phenylcyclopentane-1-carboxamide?
The InChIKey is GOWLCUBZJCXJFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N2O2/c26-22(23(12-4-5-13-23)20-6-2-1-3-7-20)24-18-19-8-10-21(11-9-19)25-14-16-27-17-15-25/h1-3,6-11H,4-5,12-18H2,(H,24,26).
What are the key properties of N-[(4-morpholin-4-ylphenyl)methyl]-1-phenylcyclopentane-1-carboxamide?
N-[(4-morpholin-4-ylphenyl)methyl]-1-phenylcyclopentane-1-carboxamide has a molecular weight of 364.49 g/mol, XLogP of 3.65, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-morpholin-4-ylphenyl)methyl]-1-phenylcyclopentane-1-carboxamide is sourced from PubChem (CID 56922098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).