2-hydroxy-3-[2-(2-methoxyphenoxy)ethylamino]propanamide

C12H18N2O4 — CID 106174794

IUPAC2-hydroxy-3-[2-(2-methoxyphenoxy)ethylamino]propanamide
SMILESCOc1ccccc1OCCNCC(O)C(N)=O
InChIInChI=1S/C12H18N2O4/c1-17-10-4-2-3-5-11(10)18-7-6-14-8-9(15)12(13)16/h2-5,9,14-15H,6-8H2,1H3,(H2,13,16)
InChIKeyUDHVPNPZFGJQPG-UHFFFAOYSA-N
MW254.29 g/mol
LogP-0.49
Rot. Bonds8

About 2-hydroxy-3-[2-(2-methoxyphenoxy)ethylamino]propanamide

2-hydroxy-3-[2-(2-methoxyphenoxy)ethylamino]propanamide (PubChem CID 106174794) has the molecular formula C12H18N2O4 and a molecular weight of 254.29 g/mol. Its IUPAC name is 2-hydroxy-3-[2-(2-methoxyphenoxy)ethylamino]propanamide.

Molecular Properties

Compound Name2-hydroxy-3-[2-(2-methoxyphenoxy)ethylamino]propanamide
PubChem CID106174794
Molecular FormulaC12H18N2O4
Molecular Weight254.29 g/mol
Exact Mass254.13
IUPAC Name2-hydroxy-3-[2-(2-methoxyphenoxy)ethylamino]propanamide
SMILESCOc1ccccc1OCCNCC(O)C(N)=O
InChIInChI=1S/C12H18N2O4/c1-17-10-4-2-3-5-11(10)18-7-6-14-8-9(15)12(13)16/h2-5,9,14-15H,6-8H2,1H3,(H2,13,16)
InChIKeyUDHVPNPZFGJQPG-UHFFFAOYSA-N
XLogP-0.49
TPSA93.81 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 5-0.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-[2-[(3-amino-2-hydroxy-3-oxopropyl)amino]ethoxy]benzoic acid
CID 106178113
methyl 2-iodo-3-[2-(2-methoxyphenoxy)ethylamino]propanoate
CID 103492017
N-[2-(2-methoxyphenoxy)ethyl]-2-methylpropan-1-amine;hydrochloride
CID 117067322
1-[2-(2-methoxyphenoxy)ethylamino]-4-methylpentan-2-ol
CID 107152431
(2S)-1-[2-(2-methoxyphenoxy)ethylamino]-3-propoxypropan-2-ol
CID 125487777
2-[2-(2-methoxyphenoxy)ethylamino]-1-thiophen-3-ylethanol
CID 106435231
N-[2-(2-methoxyphenoxy)ethyl]-2-methylpropanamide
CID 113099759
5-[2-(2-methoxyphenoxy)ethylamino]pentan-2-ol
CID 114147540
N-ethyl-2-[2-(2-methoxyphenoxy)ethylamino]acetamide
CID 60672629
4-[1-hydroxy-2-[2-(2-methoxyphenoxy)ethylamino]ethyl]-2-methylbenzenesulfonamide
CID 23615563
(2R)-1-[(E)-hex-3-enoxy]-3-[2-(2-methoxyphenoxy)ethylamino]propan-2-ol
CID 125487765
1-[2-(2-methoxyphenoxy)ethylamino]-2-methylpropan-2-ol
CID 63239759

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-3-[2-(2-methoxyphenoxy)ethylamino]propanamide?
The IUPAC name of 2-hydroxy-3-[2-(2-methoxyphenoxy)ethylamino]propanamide (CID 106174794) is 2-hydroxy-3-[2-(2-methoxyphenoxy)ethylamino]propanamide.
What is the SMILES notation for 2-hydroxy-3-[2-(2-methoxyphenoxy)ethylamino]propanamide?
The canonical SMILES for 2-hydroxy-3-[2-(2-methoxyphenoxy)ethylamino]propanamide is COc1ccccc1OCCNCC(O)C(N)=O.
What is the InChIKey of 2-hydroxy-3-[2-(2-methoxyphenoxy)ethylamino]propanamide?
The InChIKey is UDHVPNPZFGJQPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O4/c1-17-10-4-2-3-5-11(10)18-7-6-14-8-9(15)12(13)16/h2-5,9,14-15H,6-8H2,1H3,(H2,13,16).
What are the key properties of 2-hydroxy-3-[2-(2-methoxyphenoxy)ethylamino]propanamide?
2-hydroxy-3-[2-(2-methoxyphenoxy)ethylamino]propanamide has a molecular weight of 254.29 g/mol, XLogP of -0.49, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-3-[2-(2-methoxyphenoxy)ethylamino]propanamide is sourced from PubChem (CID 106174794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).