N-(2-morpholin-4-ium-4-ylethyl)-1-phenylcyclopentane-1-carboxamide

C18H27N2O2+ — CID 6987548

IUPACN-(2-morpholin-4-ium-4-ylethyl)-1-phenylcyclopentane-1-carboxamide
SMILESO=C(NCC[NH+]1CCOCC1)C1(c2ccccc2)CCCC1
InChIInChI=1S/C18H26N2O2/c21-17(19-10-11-20-12-14-22-15-13-20)18(8-4-5-9-18)16-6-2-1-3-7-16/h1-3,6-7H,4-5,8-15H2,(H,19,21)/p+1
InChIKeyGBTLWBISICGQLQ-UHFFFAOYSA-O
MW303.43 g/mol
LogP0.53
Rot. Bonds5

About N-(2-morpholin-4-ium-4-ylethyl)-1-phenylcyclopentane-1-carboxamide

N-(2-morpholin-4-ium-4-ylethyl)-1-phenylcyclopentane-1-carboxamide (PubChem CID 6987548) has the molecular formula C18H27N2O2+ and a molecular weight of 303.43 g/mol. Its IUPAC name is N-(2-morpholin-4-ium-4-ylethyl)-1-phenylcyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-(2-morpholin-4-ium-4-ylethyl)-1-phenylcyclopentane-1-carboxamide
PubChem CID6987548
Molecular FormulaC18H27N2O2+
Molecular Weight303.43 g/mol
Exact Mass303.21
IUPAC NameN-(2-morpholin-4-ium-4-ylethyl)-1-phenylcyclopentane-1-carboxamide
SMILESO=C(NCC[NH+]1CCOCC1)C1(c2ccccc2)CCCC1
InChIInChI=1S/C18H26N2O2/c21-17(19-10-11-20-12-14-22-15-13-20)18(8-4-5-9-18)16-6-2-1-3-7-16/h1-3,6-7H,4-5,8-15H2,(H,19,21)/p+1
InChIKeyGBTLWBISICGQLQ-UHFFFAOYSA-O
XLogP0.53
TPSA42.77 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.43
LogP ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(2-morpholin-4-ium-4-ylethyl)-1-phenylcyclopentane-1-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

N-ethyl-1-phenylcyclopentane-1-carboxamide
CID 778764
N-(2-morpholin-4-ium-4-ylethyl)-4-thiophen-2-yloxane-4-carboxamide
CID 7243535
N-(3-amino-3-oxopropyl)-1-phenylcyclopentane-1-carboxamide
CID 110473789
N-(2-aminoethyl)-1-phenylcyclobutane-1-carboxamide;hydrochloride
CID 119383117
1-phenyl-N-(2-phenylsulfanylethyl)cyclopentane-1-carboxamide
CID 39630901
N-(2-phenoxyethyl)-1-phenylcyclopentane-1-carboxamide
CID 100543641
N-(2-morpholin-4-ium-4-ylethyl)-3,3-diphenylpropanamide
CID 6919320
1-[[(4-phenyloxane-4-carbonyl)amino]methyl]cyclohexane-1-carboxylic acid
CID 120544882
N-[(4-morpholin-4-ylphenyl)methyl]-1-phenylcyclopentane-1-carboxamide
CID 56922098
N-(6-aminohexyl)-1-phenylcyclopentane-1-carboxamide;hydrochloride
CID 142770343
2-morpholin-4-ium-4-yl-N-[(1-phenylcyclopentyl)methyl]acetamide
CID 3532070
N-[(3R)-3-hydroxy-3-phenylpropyl]-4-phenyloxane-4-carboxamide
CID 96568311

Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ium-4-ylethyl)-1-phenylcyclopentane-1-carboxamide?
The IUPAC name of N-(2-morpholin-4-ium-4-ylethyl)-1-phenylcyclopentane-1-carboxamide (CID 6987548) is N-(2-morpholin-4-ium-4-ylethyl)-1-phenylcyclopentane-1-carboxamide.
What is the SMILES notation for N-(2-morpholin-4-ium-4-ylethyl)-1-phenylcyclopentane-1-carboxamide?
The canonical SMILES for N-(2-morpholin-4-ium-4-ylethyl)-1-phenylcyclopentane-1-carboxamide is O=C(NCC[NH+]1CCOCC1)C1(c2ccccc2)CCCC1.
What is the InChIKey of N-(2-morpholin-4-ium-4-ylethyl)-1-phenylcyclopentane-1-carboxamide?
The InChIKey is GBTLWBISICGQLQ-UHFFFAOYSA-O. The full InChI is InChI=1S/C18H26N2O2/c21-17(19-10-11-20-12-14-22-15-13-20)18(8-4-5-9-18)16-6-2-1-3-7-16/h1-3,6-7H,4-5,8-15H2,(H,19,21)/p+1.
What are the key properties of N-(2-morpholin-4-ium-4-ylethyl)-1-phenylcyclopentane-1-carboxamide?
N-(2-morpholin-4-ium-4-ylethyl)-1-phenylcyclopentane-1-carboxamide has a molecular weight of 303.43 g/mol, XLogP of 0.53, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ium-4-ylethyl)-1-phenylcyclopentane-1-carboxamide is sourced from PubChem (CID 6987548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).