1-(9-ethylcarbazol-3-yl)propane-1,2,3-triol

C17H19NO3 — CID 170819012

IUPAC1-(9-ethylcarbazol-3-yl)propane-1,2,3-triol
SMILESCCn1c2ccccc2c2cc(C(O)C(O)CO)ccc21
InChIInChI=1S/C17H19NO3/c1-2-18-14-6-4-3-5-12(14)13-9-11(7-8-15(13)18)17(21)16(20)10-19/h3-9,16-17,19-21H,2,10H2,1H3
InChIKeyRJNIYAXASYZFOE-UHFFFAOYSA-N
MW285.34 g/mol
LogP2.20
Rot. Bonds4

About 1-(9-ethylcarbazol-3-yl)propane-1,2,3-triol

1-(9-ethylcarbazol-3-yl)propane-1,2,3-triol (PubChem CID 170819012) has the molecular formula C17H19NO3 and a molecular weight of 285.34 g/mol. Its IUPAC name is 1-(9-ethylcarbazol-3-yl)propane-1,2,3-triol.

Molecular Properties

Compound Name1-(9-ethylcarbazol-3-yl)propane-1,2,3-triol
PubChem CID170819012
Molecular FormulaC17H19NO3
Molecular Weight285.34 g/mol
Exact Mass285.14
IUPAC Name1-(9-ethylcarbazol-3-yl)propane-1,2,3-triol
SMILESCCn1c2ccccc2c2cc(C(O)C(O)CO)ccc21
InChIInChI=1S/C17H19NO3/c1-2-18-14-6-4-3-5-12(14)13-9-11(7-8-15(13)18)17(21)16(20)10-19/h3-9,16-17,19-21H,2,10H2,1H3
InChIKeyRJNIYAXASYZFOE-UHFFFAOYSA-N
XLogP2.20
TPSA65.62 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.34
LogP ≤ 52.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-1-(9-ethylcarbazol-3-yl)propane-1,2-diol
CID 170829191
2-(9-ethylcarbazol-3-yl)-2-hydroxyacetic acid
CID 117426376
3-butan-2-yl-9-ethylcarbazole
CID 23520664
9-ethyl-3-[(9-ethylcarbazol-3-yl)-(4-phenylphenyl)methyl]carbazole
CID 14093933
(1R)-1-(9-ethylcarbazol-3-yl)-2-fluoroethanamine;hydrochloride
CID 171232651
(1S,2R)-2-amino-1-cyclopropyl-2-(9-ethylcarbazol-3-yl)ethanol;hydrochloride
CID 171264882
(1S,2R)-2-amino-1-cyclopentyl-2-(9-ethylcarbazol-3-yl)ethanol
CID 171264885
1-(9-ethylcarbazol-3-yl)propan-2-ol
CID 117386647
(R)-cyclopropyl-(9-ethylcarbazol-3-yl)methanamine
CID 171213067
(1S)-1-(9-ethylcarbazol-3-yl)butane-1,4-diamine
CID 171232656
(3S)-3-amino-3-(9-ethylcarbazol-3-yl)propanenitrile
CID 171260153
(1R)-1-(9-ethylcarbazol-3-yl)pentane-1,5-diamine
CID 171213041

Frequently Asked Questions

What is the IUPAC name of 1-(9-ethylcarbazol-3-yl)propane-1,2,3-triol?
The IUPAC name of 1-(9-ethylcarbazol-3-yl)propane-1,2,3-triol (CID 170819012) is 1-(9-ethylcarbazol-3-yl)propane-1,2,3-triol.
What is the SMILES notation for 1-(9-ethylcarbazol-3-yl)propane-1,2,3-triol?
The canonical SMILES for 1-(9-ethylcarbazol-3-yl)propane-1,2,3-triol is CCn1c2ccccc2c2cc(C(O)C(O)CO)ccc21.
What is the InChIKey of 1-(9-ethylcarbazol-3-yl)propane-1,2,3-triol?
The InChIKey is RJNIYAXASYZFOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO3/c1-2-18-14-6-4-3-5-12(14)13-9-11(7-8-15(13)18)17(21)16(20)10-19/h3-9,16-17,19-21H,2,10H2,1H3.
What are the key properties of 1-(9-ethylcarbazol-3-yl)propane-1,2,3-triol?
1-(9-ethylcarbazol-3-yl)propane-1,2,3-triol has a molecular weight of 285.34 g/mol, XLogP of 2.20, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(9-ethylcarbazol-3-yl)propane-1,2,3-triol is sourced from PubChem (CID 170819012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).