2-[3-amino-N-(2-hydroxyethyl)anilino]ethanol

C10H16N2O2 — CID 10130362

IUPAC2-[3-amino-N-(2-hydroxyethyl)anilino]ethanol
SMILESNc1cccc(N(CCO)CCO)c1
InChIInChI=1S/C10H16N2O2/c11-9-2-1-3-10(8-9)12(4-6-13)5-7-14/h1-3,8,13-14H,4-7,11H2
InChIKeyMQMMMSDSVNOFJM-UHFFFAOYSA-N
MW196.25 g/mol
LogP0.06
Rot. Bonds5

About 2-[3-amino-N-(2-hydroxyethyl)anilino]ethanol

2-[3-amino-N-(2-hydroxyethyl)anilino]ethanol (PubChem CID 10130362) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 2-[3-amino-N-(2-hydroxyethyl)anilino]ethanol.

Molecular Properties

Compound Name2-[3-amino-N-(2-hydroxyethyl)anilino]ethanol
PubChem CID10130362
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name2-[3-amino-N-(2-hydroxyethyl)anilino]ethanol
SMILESNc1cccc(N(CCO)CCO)c1
InChIInChI=1S/C10H16N2O2/c11-9-2-1-3-10(8-9)12(4-6-13)5-7-14/h1-3,8,13-14H,4-7,11H2
InChIKeyMQMMMSDSVNOFJM-UHFFFAOYSA-N
XLogP0.06
TPSA69.72 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 50.06
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[3-amino-N-(2-hydroxyethyl)anilino]ethanol?
The IUPAC name of 2-[3-amino-N-(2-hydroxyethyl)anilino]ethanol (CID 10130362) is 2-[3-amino-N-(2-hydroxyethyl)anilino]ethanol.
What is the SMILES notation for 2-[3-amino-N-(2-hydroxyethyl)anilino]ethanol?
The canonical SMILES for 2-[3-amino-N-(2-hydroxyethyl)anilino]ethanol is Nc1cccc(N(CCO)CCO)c1.
What is the InChIKey of 2-[3-amino-N-(2-hydroxyethyl)anilino]ethanol?
The InChIKey is MQMMMSDSVNOFJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c11-9-2-1-3-10(8-9)12(4-6-13)5-7-14/h1-3,8,13-14H,4-7,11H2.
What are the key properties of 2-[3-amino-N-(2-hydroxyethyl)anilino]ethanol?
2-[3-amino-N-(2-hydroxyethyl)anilino]ethanol has a molecular weight of 196.25 g/mol, XLogP of 0.06, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-amino-N-(2-hydroxyethyl)anilino]ethanol is sourced from PubChem (CID 10130362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).