N-[(1R)-2-morpholin-4-ium-4-yl-1-phenylethyl]quinoline-2-carboxamide

C22H24N3O2+ — CID 9148328

IUPACN-[(1R)-2-morpholin-4-ium-4-yl-1-phenylethyl]quinoline-2-carboxamide
SMILESO=C(N[C@@H](C[NH+]1CCOCC1)c1ccccc1)c1ccc2ccccc2n1
InChIInChI=1S/C22H23N3O2/c26-22(20-11-10-18-8-4-5-9-19(18)23-20)24-21(17-6-2-1-3-7-17)16-25-12-14-27-15-13-25/h1-11,21H,12-16H2,(H,24,26)/p+1/t21-/m0/s1
InChIKeyUOXUHZRGUMMLOS-NRFANRHFSA-O
MW362.45 g/mol
LogP1.62
Rot. Bonds5

About N-[(1R)-2-morpholin-4-ium-4-yl-1-phenylethyl]quinoline-2-carboxamide

N-[(1R)-2-morpholin-4-ium-4-yl-1-phenylethyl]quinoline-2-carboxamide (PubChem CID 9148328) has the molecular formula C22H24N3O2+ and a molecular weight of 362.45 g/mol. Its IUPAC name is N-[(1R)-2-morpholin-4-ium-4-yl-1-phenylethyl]quinoline-2-carboxamide.

Molecular Properties

Compound NameN-[(1R)-2-morpholin-4-ium-4-yl-1-phenylethyl]quinoline-2-carboxamide
PubChem CID9148328
Molecular FormulaC22H24N3O2+
Molecular Weight362.45 g/mol
Exact Mass362.19
IUPAC NameN-[(1R)-2-morpholin-4-ium-4-yl-1-phenylethyl]quinoline-2-carboxamide
SMILESO=C(N[C@@H](C[NH+]1CCOCC1)c1ccccc1)c1ccc2ccccc2n1
InChIInChI=1S/C22H23N3O2/c26-22(20-11-10-18-8-4-5-9-19(18)23-20)24-21(17-6-2-1-3-7-17)16-25-12-14-27-15-13-25/h1-11,21H,12-16H2,(H,24,26)/p+1/t21-/m0/s1
InChIKeyUOXUHZRGUMMLOS-NRFANRHFSA-O
XLogP1.62
TPSA55.66 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.45
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[(1R)-2-morpholin-4-ium-4-yl-1-phenylethyl]quinoline-2-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

4-chloro-N-[(1R)-2-morpholin-4-ium-4-yl-1-phenylethyl]benzamide
CID 9148310
4-methoxy-N-[(1R)-2-morpholin-4-ium-4-yl-1-phenylethyl]benzamide
CID 9148385
N-[3-(dipropylamino)-1-phenylpropyl]quinoline-2-carboxamide
CID 21297679
3-methyl-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenylethyl]-4-oxophthalazine-1-carboxamide
CID 9149237
N-[2-[[(1R)-2-morpholin-4-ium-4-yl-1-phenylethyl]amino]-2-oxoethyl]furan-2-carboxamide
CID 9149121
2-benzo[e][1]benzofuran-1-yl-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenylethyl]acetamide
CID 9149455
2-(4-methoxyphenyl)sulfanyl-N-[(1R)-2-morpholin-4-ium-4-yl-1-phenylethyl]acetamide
CID 9150013
N-[(1R)-2-amino-2-oxo-1-phenylethyl]quinoline-2-carboxamide
CID 51492407
N-[(2S)-3-hydroxy-1-morpholin-4-yl-1-oxopropan-2-yl]quinoline-2-carboxamide
CID 6723977
N-[(1R)-1-phenylpropyl]-1,6-naphthyridine-2-carboxamide
CID 16731063
N-(5-methylhexan-2-yl)quinoline-2-carboxamide
CID 24554913
N-(2-phenylbutyl)quinoline-2-carboxamide
CID 46635493

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-2-morpholin-4-ium-4-yl-1-phenylethyl]quinoline-2-carboxamide?
The IUPAC name of N-[(1R)-2-morpholin-4-ium-4-yl-1-phenylethyl]quinoline-2-carboxamide (CID 9148328) is N-[(1R)-2-morpholin-4-ium-4-yl-1-phenylethyl]quinoline-2-carboxamide.
What is the SMILES notation for N-[(1R)-2-morpholin-4-ium-4-yl-1-phenylethyl]quinoline-2-carboxamide?
The canonical SMILES for N-[(1R)-2-morpholin-4-ium-4-yl-1-phenylethyl]quinoline-2-carboxamide is O=C(N[C@@H](C[NH+]1CCOCC1)c1ccccc1)c1ccc2ccccc2n1.
What is the InChIKey of N-[(1R)-2-morpholin-4-ium-4-yl-1-phenylethyl]quinoline-2-carboxamide?
The InChIKey is UOXUHZRGUMMLOS-NRFANRHFSA-O. The full InChI is InChI=1S/C22H23N3O2/c26-22(20-11-10-18-8-4-5-9-19(18)23-20)24-21(17-6-2-1-3-7-17)16-25-12-14-27-15-13-25/h1-11,21H,12-16H2,(H,24,26)/p+1/t21-/m0/s1.
What are the key properties of N-[(1R)-2-morpholin-4-ium-4-yl-1-phenylethyl]quinoline-2-carboxamide?
N-[(1R)-2-morpholin-4-ium-4-yl-1-phenylethyl]quinoline-2-carboxamide has a molecular weight of 362.45 g/mol, XLogP of 1.62, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-2-morpholin-4-ium-4-yl-1-phenylethyl]quinoline-2-carboxamide is sourced from PubChem (CID 9148328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).