1-carbazol-9-yl-3-(2-hydroxyethylamino)propan-2-ol

C17H20N2O2 — CID 2859847

IUPAC1-carbazol-9-yl-3-(2-hydroxyethylamino)propan-2-ol
SMILESOCCNCC(O)Cn1c2ccccc2c2ccccc21
InChIInChI=1S/C17H20N2O2/c20-10-9-18-11-13(21)12-19-16-7-3-1-5-14(16)15-6-2-4-8-17(15)19/h1-8,13,18,20-21H,9-12H2
InChIKeyQZUDLONPOLSENE-UHFFFAOYSA-N
MW284.36 g/mol
LogP1.74
Rot. Bonds6

About 1-carbazol-9-yl-3-(2-hydroxyethylamino)propan-2-ol

1-carbazol-9-yl-3-(2-hydroxyethylamino)propan-2-ol (PubChem CID 2859847) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 1-carbazol-9-yl-3-(2-hydroxyethylamino)propan-2-ol.

Molecular Properties

Compound Name1-carbazol-9-yl-3-(2-hydroxyethylamino)propan-2-ol
PubChem CID2859847
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name1-carbazol-9-yl-3-(2-hydroxyethylamino)propan-2-ol
SMILESOCCNCC(O)Cn1c2ccccc2c2ccccc21
InChIInChI=1S/C17H20N2O2/c20-10-9-18-11-13(21)12-19-16-7-3-1-5-14(16)15-6-2-4-8-17(15)19/h1-8,13,18,20-21H,9-12H2
InChIKeyQZUDLONPOLSENE-UHFFFAOYSA-N
XLogP1.74
TPSA57.42 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 51.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-carbazol-9-yl-3-(2-hydroxyethylamino)propan-2-ol?
The IUPAC name of 1-carbazol-9-yl-3-(2-hydroxyethylamino)propan-2-ol (CID 2859847) is 1-carbazol-9-yl-3-(2-hydroxyethylamino)propan-2-ol.
What is the SMILES notation for 1-carbazol-9-yl-3-(2-hydroxyethylamino)propan-2-ol?
The canonical SMILES for 1-carbazol-9-yl-3-(2-hydroxyethylamino)propan-2-ol is OCCNCC(O)Cn1c2ccccc2c2ccccc21.
What is the InChIKey of 1-carbazol-9-yl-3-(2-hydroxyethylamino)propan-2-ol?
The InChIKey is QZUDLONPOLSENE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c20-10-9-18-11-13(21)12-19-16-7-3-1-5-14(16)15-6-2-4-8-17(15)19/h1-8,13,18,20-21H,9-12H2.
What are the key properties of 1-carbazol-9-yl-3-(2-hydroxyethylamino)propan-2-ol?
1-carbazol-9-yl-3-(2-hydroxyethylamino)propan-2-ol has a molecular weight of 284.36 g/mol, XLogP of 1.74, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-carbazol-9-yl-3-(2-hydroxyethylamino)propan-2-ol is sourced from PubChem (CID 2859847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).