4-(2-aminoethylamino)phenol

C8H12N2O — CID 15538569

IUPAC4-(2-aminoethylamino)phenol
SMILESNCCNc1ccc(O)cc1
InChIInChI=1S/C8H12N2O/c9-5-6-10-7-1-3-8(11)4-2-7/h1-4,10-11H,5-6,9H2
InChIKeyBFTCOOLIWWXDEJ-UHFFFAOYSA-N
MW152.20 g/mol
LogP0.76
Rot. Bonds3

About 4-(2-aminoethylamino)phenol

4-(2-aminoethylamino)phenol (PubChem CID 15538569) has the molecular formula C8H12N2O and a molecular weight of 152.20 g/mol. Its IUPAC name is 4-(2-aminoethylamino)phenol.

Molecular Properties

Compound Name4-(2-aminoethylamino)phenol
PubChem CID15538569
Molecular FormulaC8H12N2O
Molecular Weight152.20 g/mol
Exact Mass152.09
IUPAC Name4-(2-aminoethylamino)phenol
SMILESNCCNc1ccc(O)cc1
InChIInChI=1S/C8H12N2O/c9-5-6-10-7-1-3-8(11)4-2-7/h1-4,10-11H,5-6,9H2
InChIKeyBFTCOOLIWWXDEJ-UHFFFAOYSA-N
XLogP0.76
TPSA58.28 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 50.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

bis(4-(2-aminoethylamino)phenol);oxotitanium(1+);N'-phenylethane-1,2-diamine
CID 87933335
N'-(4-phenylphenyl)ethane-1,2-diamine
CID 15319687
ethane;N'-phenylethane-1,2-diamine
CID 91048519
N'-(4-methylsulfanylphenyl)ethane-1,2-diamine
CID 15686149
4-[[2-(aminomethyl)-3,3,3-trifluoropropyl]amino]phenol
CID 84726902
N'-[4-(2-methylpropyl)phenyl]ethane-1,2-diamine
CID 59849275
N'-[4-[(2-methylpropan-2-yl)oxy]phenyl]ethane-1,2-diamine
CID 96671315
[4-(3-aminopropylamino)phenyl]boronic acid
CID 119085441
N'-(4-pyrrol-1-ylphenyl)ethane-1,2-diamine
CID 84670175
4-(2-propoxyethylamino)phenol
CID 162495053
molecular hydrogen;N'-phenylethane-1,2-diamine;propane
CID 143734576
4-(2-aminoethylamino)-2,6-dichlorophenol
CID 130589167

Frequently Asked Questions

What is the IUPAC name of 4-(2-aminoethylamino)phenol?
The IUPAC name of 4-(2-aminoethylamino)phenol (CID 15538569) is 4-(2-aminoethylamino)phenol.
What is the SMILES notation for 4-(2-aminoethylamino)phenol?
The canonical SMILES for 4-(2-aminoethylamino)phenol is NCCNc1ccc(O)cc1.
What is the InChIKey of 4-(2-aminoethylamino)phenol?
The InChIKey is BFTCOOLIWWXDEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O/c9-5-6-10-7-1-3-8(11)4-2-7/h1-4,10-11H,5-6,9H2.
What are the key properties of 4-(2-aminoethylamino)phenol?
4-(2-aminoethylamino)phenol has a molecular weight of 152.20 g/mol, XLogP of 0.76, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-aminoethylamino)phenol is sourced from PubChem (CID 15538569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).