2-[2-[2-[2-(4-aminoanilino)ethoxy]ethoxy]ethoxy]ethanol

C14H24N2O4 — CID 150016700

IUPAC2-[2-[2-[2-(4-aminoanilino)ethoxy]ethoxy]ethoxy]ethanol
SMILESNc1ccc(NCCOCCOCCOCCO)cc1
InChIInChI=1S/C14H24N2O4/c15-13-1-3-14(4-2-13)16-5-7-18-9-11-20-12-10-19-8-6-17/h1-4,16-17H,5-12,15H2
InChIKeyDEKLXWOQHIJELZ-UHFFFAOYSA-N
MW284.36 g/mol
LogP0.72
Rot. Bonds12

About 2-[2-[2-[2-(4-aminoanilino)ethoxy]ethoxy]ethoxy]ethanol

2-[2-[2-[2-(4-aminoanilino)ethoxy]ethoxy]ethoxy]ethanol (PubChem CID 150016700) has the molecular formula C14H24N2O4 and a molecular weight of 284.36 g/mol. Its IUPAC name is 2-[2-[2-[2-(4-aminoanilino)ethoxy]ethoxy]ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-[2-[2-(4-aminoanilino)ethoxy]ethoxy]ethoxy]ethanol
PubChem CID150016700
Molecular FormulaC14H24N2O4
Molecular Weight284.36 g/mol
Exact Mass284.17
IUPAC Name2-[2-[2-[2-(4-aminoanilino)ethoxy]ethoxy]ethoxy]ethanol
SMILESNc1ccc(NCCOCCOCCOCCO)cc1
InChIInChI=1S/C14H24N2O4/c15-13-1-3-14(4-2-13)16-5-7-18-9-11-20-12-10-19-8-6-17/h1-4,16-17H,5-12,15H2
InChIKeyDEKLXWOQHIJELZ-UHFFFAOYSA-N
XLogP0.72
TPSA85.97 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 50.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_no_alk(40)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-[2-[2-[4-[4-[2-[2-(2-hydroxyethoxy)ethoxy]ethylamino]phenyl]anilino]ethoxy]ethoxy]ethanol
CID 10433809
2-[2-[4-amino-2-(trifluoromethyl)anilino]ethoxy]ethanol
CID 14793683
4-N-(2-methoxyethyl)benzene-1,4-diamine;hydrochloride
CID 68602874
2-[2-(3-amino-5-propan-2-yloxyanilino)ethoxy]ethanol
CID 80739762
4-[2-(2-hydroxyethoxy)ethylamino]-N,N-dimethylbenzenesulfonamide
CID 62498471
1-(4-aminophenyl)-2-[2-(2-hydroxyethoxy)ethylamino]ethanone
CID 82258219
4-N-(2-methoxyethyl)benzene-1,4-diamine;sulfuric acid
CID 71375043
2-[2-[1-(4-aminophenyl)propan-2-ylamino]ethoxy]ethanol
CID 82257190
4-[3-(2-hydroxyethoxy)propylamino]benzenesulfonamide
CID 106306869
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[4-[(4-chlorophenyl)-[4-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethylimino]cyclohexa-2,5-dien-1-ylidene]methyl]anilino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 25053869
3-(4-aminophenyl)-N-[2-(2-hydroxyethoxy)ethyl]propanamide
CID 62499083
4-N-(2-aminoprop-2-enyl)benzene-1,4-diamine
CID 70185989

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-[2-(4-aminoanilino)ethoxy]ethoxy]ethoxy]ethanol?
The IUPAC name of 2-[2-[2-[2-(4-aminoanilino)ethoxy]ethoxy]ethoxy]ethanol (CID 150016700) is 2-[2-[2-[2-(4-aminoanilino)ethoxy]ethoxy]ethoxy]ethanol.
What is the SMILES notation for 2-[2-[2-[2-(4-aminoanilino)ethoxy]ethoxy]ethoxy]ethanol?
The canonical SMILES for 2-[2-[2-[2-(4-aminoanilino)ethoxy]ethoxy]ethoxy]ethanol is Nc1ccc(NCCOCCOCCOCCO)cc1.
What is the InChIKey of 2-[2-[2-[2-(4-aminoanilino)ethoxy]ethoxy]ethoxy]ethanol?
The InChIKey is DEKLXWOQHIJELZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O4/c15-13-1-3-14(4-2-13)16-5-7-18-9-11-20-12-10-19-8-6-17/h1-4,16-17H,5-12,15H2.
What are the key properties of 2-[2-[2-[2-(4-aminoanilino)ethoxy]ethoxy]ethoxy]ethanol?
2-[2-[2-[2-(4-aminoanilino)ethoxy]ethoxy]ethoxy]ethanol has a molecular weight of 284.36 g/mol, XLogP of 0.72, 12 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-[2-(4-aminoanilino)ethoxy]ethoxy]ethoxy]ethanol is sourced from PubChem (CID 150016700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).