N-[2-[[2-hydroxy-3-(4-methoxyphenoxy)propyl]amino]ethyl]morpholine-4-carboxamide

C17H27N3O5 — CID 155893558

IUPACN-[2-[[2-hydroxy-3-(4-methoxyphenoxy)propyl]amino]ethyl]morpholine-4-carboxamide
SMILESCOc1ccc(OCC(O)CNCCNC(=O)N2CCOCC2)cc1
InChIInChI=1S/C17H27N3O5/c1-23-15-2-4-16(5-3-15)25-13-14(21)12-18-6-7-19-17(22)20-8-10-24-11-9-20/h2-5,14,18,21H,6-13H2,1H3,(H,19,22)
InChIKeyKDIKXVULGNFRQC-UHFFFAOYSA-N
MW353.42 g/mol
LogP0.07
Rot. Bonds9

About N-[2-[[2-hydroxy-3-(4-methoxyphenoxy)propyl]amino]ethyl]morpholine-4-carboxamide

N-[2-[[2-hydroxy-3-(4-methoxyphenoxy)propyl]amino]ethyl]morpholine-4-carboxamide (PubChem CID 155893558) has the molecular formula C17H27N3O5 and a molecular weight of 353.42 g/mol. Its IUPAC name is N-[2-[[2-hydroxy-3-(4-methoxyphenoxy)propyl]amino]ethyl]morpholine-4-carboxamide.

Molecular Properties

Compound NameN-[2-[[2-hydroxy-3-(4-methoxyphenoxy)propyl]amino]ethyl]morpholine-4-carboxamide
PubChem CID155893558
Molecular FormulaC17H27N3O5
Molecular Weight353.42 g/mol
Exact Mass353.20
IUPAC NameN-[2-[[2-hydroxy-3-(4-methoxyphenoxy)propyl]amino]ethyl]morpholine-4-carboxamide
SMILESCOc1ccc(OCC(O)CNCCNC(=O)N2CCOCC2)cc1
InChIInChI=1S/C17H27N3O5/c1-23-15-2-4-16(5-3-15)25-13-14(21)12-18-6-7-19-17(22)20-8-10-24-11-9-20/h2-5,14,18,21H,6-13H2,1H3,(H,19,22)
InChIKeyKDIKXVULGNFRQC-UHFFFAOYSA-N
XLogP0.07
TPSA92.29 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.42
LogP ≤ 50.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[2-[[2-hydroxy-3-(4-methoxyphenoxy)propyl]amino]ethyl]morpholine-4-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-[2-[[(2S)-3-(4-fluorophenoxy)-2-hydroxypropyl]amino]ethyl]morpholine-4-carboxamide
CID 155021513
bis(N-[2-[[(2R)-2-hydroxy-3-(4-hydroxyphenoxy)propyl]amino]ethyl]morpholine-4-carboxamide);oxalic acid
CID 91825958
N-[2-(2-hydroxypropylamino)ethyl]morpholine-4-carboxamide
CID 104593900
N-[(4-methoxyphenyl)methyl]morpholine-4-carboxamide
CID 669628
1-[4-[2-hydroxy-3-(3-morpholin-4-ylpropylamino)propoxy]phenoxy]-3-(3-morpholin-4-ylpropylamino)propan-2-ol
CID 19133409
2-[4-[2-[(2-hydroxy-3-phenoxypropyl)amino]ethyl]phenoxy]-1-morpholin-4-ylethanone
CID 67826771
4-[4-[2-[[(2S)-2-hydroxy-3-(4-hydroxyphenoxy)propyl]amino]ethyl]anilino]-N-(3-morpholin-4-yl-3-oxopropyl)piperidine-1-carboxamide
CID 10303404
N-[2-[[2-hydroxy-3-(4-methoxyphenoxy)propyl]amino]ethyl]methanesulfonamide
CID 60909902
[1-[2-[[2-hydroxy-3-[4-[2-(2-methylpropoxy)ethoxy]phenoxy]propyl]amino]ethylcarbamoyl]piperidin-4-yl] 2-methylpropanoate
CID 57072379
1-(4-methoxyphenoxy)-3-(2-methylpropylamino)propan-2-ol
CID 559347
N-[2-(diethylamino)-2-(4-methoxyphenyl)ethyl]morpholine-4-carboxamide
CID 112503691
N-(3-hydroxy-4-methoxybutyl)morpholine-4-carboxamide
CID 103876112

Frequently Asked Questions

What is the IUPAC name of N-[2-[[2-hydroxy-3-(4-methoxyphenoxy)propyl]amino]ethyl]morpholine-4-carboxamide?
The IUPAC name of N-[2-[[2-hydroxy-3-(4-methoxyphenoxy)propyl]amino]ethyl]morpholine-4-carboxamide (CID 155893558) is N-[2-[[2-hydroxy-3-(4-methoxyphenoxy)propyl]amino]ethyl]morpholine-4-carboxamide.
What is the SMILES notation for N-[2-[[2-hydroxy-3-(4-methoxyphenoxy)propyl]amino]ethyl]morpholine-4-carboxamide?
The canonical SMILES for N-[2-[[2-hydroxy-3-(4-methoxyphenoxy)propyl]amino]ethyl]morpholine-4-carboxamide is COc1ccc(OCC(O)CNCCNC(=O)N2CCOCC2)cc1.
What is the InChIKey of N-[2-[[2-hydroxy-3-(4-methoxyphenoxy)propyl]amino]ethyl]morpholine-4-carboxamide?
The InChIKey is KDIKXVULGNFRQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O5/c1-23-15-2-4-16(5-3-15)25-13-14(21)12-18-6-7-19-17(22)20-8-10-24-11-9-20/h2-5,14,18,21H,6-13H2,1H3,(H,19,22).
What are the key properties of N-[2-[[2-hydroxy-3-(4-methoxyphenoxy)propyl]amino]ethyl]morpholine-4-carboxamide?
N-[2-[[2-hydroxy-3-(4-methoxyphenoxy)propyl]amino]ethyl]morpholine-4-carboxamide has a molecular weight of 353.42 g/mol, XLogP of 0.07, 9 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[[2-hydroxy-3-(4-methoxyphenoxy)propyl]amino]ethyl]morpholine-4-carboxamide is sourced from PubChem (CID 155893558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).