2-anilinoacetic acid;2-[bis(2-hydroxyethyl)amino]ethanol

C14H24N2O5 — CID 130383963

IUPAC2-anilinoacetic acid;2-[bis(2-hydroxyethyl)amino]ethanol
SMILESO=C(O)CNc1ccccc1.OCCN(CCO)CCO
InChIInChI=1S/C8H9NO2.C6H15NO3/c10-8(11)6-9-7-4-2-1-3-5-7;8-4-1-7(2-5-9)3-6-10/h1-5,9H,6H2,(H,10,11);8-10H,1-6H2
InChIKeySVWVJEALZNGGHN-UHFFFAOYSA-N
MW300.35 g/mol
LogP-0.55
Rot. Bonds9

About 2-anilinoacetic acid;2-[bis(2-hydroxyethyl)amino]ethanol

2-anilinoacetic acid;2-[bis(2-hydroxyethyl)amino]ethanol (PubChem CID 130383963) has the molecular formula C14H24N2O5 and a molecular weight of 300.35 g/mol. Its IUPAC name is 2-anilinoacetic acid;2-[bis(2-hydroxyethyl)amino]ethanol.

Molecular Properties

Compound Name2-anilinoacetic acid;2-[bis(2-hydroxyethyl)amino]ethanol
PubChem CID130383963
Molecular FormulaC14H24N2O5
Molecular Weight300.35 g/mol
Exact Mass300.17
IUPAC Name2-anilinoacetic acid;2-[bis(2-hydroxyethyl)amino]ethanol
SMILESO=C(O)CNc1ccccc1.OCCN(CCO)CCO
InChIInChI=1S/C8H9NO2.C6H15NO3/c10-8(11)6-9-7-4-2-1-3-5-7;8-4-1-7(2-5-9)3-6-10/h1-5,9H,6H2,(H,10,11);8-10H,1-6H2
InChIKeySVWVJEALZNGGHN-UHFFFAOYSA-N
XLogP-0.55
TPSA113.26 Ų
H-Bond Donors5
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.35
LogP ≤ 5-0.55
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 106

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Related Compounds

2-anilinoacetic acid;hydrazine
CID 67393863
potassium;sodium;2-anilinoacetic acid;hydride
CID 174390322
2-anilinoacetic acid;formic acid
CID 174518720
2-anilino-N-ethyl-N-(2-hydroxyethyl)acetamide
CID 60945484
2-anilino-N-butyl-N-(2-hydroxyethyl)acetamide
CID 54870892
3-[2-hydroxyethyl(propyl)amino]-N-phenylpropanamide
CID 62016603
2-anilinoethanol;1,3-dihydroxypropan-2-one
CID 67927731
2-anilino-N,N-diethylacetamide;hydrochloride
CID 119671427
2-anilino-N-(3-hydroxypropyl)acetamide
CID 60861419
3-[benzyl(2-hydroxyethyl)amino]propanoic acid
CID 43841843
2-anilinoethanol;2-[bis[2-[bis(carboxymethyl)amino]ethyl]amino]acetic acid;sulfuric acid
CID 70283063
bis(2-anilinoacetate);cadmium(2+)
CID 88771971

Frequently Asked Questions

What is the IUPAC name of 2-anilinoacetic acid;2-[bis(2-hydroxyethyl)amino]ethanol?
The IUPAC name of 2-anilinoacetic acid;2-[bis(2-hydroxyethyl)amino]ethanol (CID 130383963) is 2-anilinoacetic acid;2-[bis(2-hydroxyethyl)amino]ethanol.
What is the SMILES notation for 2-anilinoacetic acid;2-[bis(2-hydroxyethyl)amino]ethanol?
The canonical SMILES for 2-anilinoacetic acid;2-[bis(2-hydroxyethyl)amino]ethanol is O=C(O)CNc1ccccc1.OCCN(CCO)CCO.
What is the InChIKey of 2-anilinoacetic acid;2-[bis(2-hydroxyethyl)amino]ethanol?
The InChIKey is SVWVJEALZNGGHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9NO2.C6H15NO3/c10-8(11)6-9-7-4-2-1-3-5-7;8-4-1-7(2-5-9)3-6-10/h1-5,9H,6H2,(H,10,11);8-10H,1-6H2.
What are the key properties of 2-anilinoacetic acid;2-[bis(2-hydroxyethyl)amino]ethanol?
2-anilinoacetic acid;2-[bis(2-hydroxyethyl)amino]ethanol has a molecular weight of 300.35 g/mol, XLogP of -0.55, 9 rotatable bonds, 5 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilinoacetic acid;2-[bis(2-hydroxyethyl)amino]ethanol is sourced from PubChem (CID 130383963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).