2-[3-(hydroxymethyl)carbazol-9-yl]ethyl acetate

C17H17NO3 — CID 143174420

IUPAC2-[3-(hydroxymethyl)carbazol-9-yl]ethyl acetate
SMILESCC(=O)OCCn1c2ccccc2c2cc(CO)ccc21
InChIInChI=1S/C17H17NO3/c1-12(20)21-9-8-18-16-5-3-2-4-14(16)15-10-13(11-19)6-7-17(15)18/h2-7,10,19H,8-9,11H2,1H3
InChIKeyHTIDMEOAPABQMM-UHFFFAOYSA-N
MW283.33 g/mol
LogP2.85
Rot. Bonds4

About 2-[3-(hydroxymethyl)carbazol-9-yl]ethyl acetate

2-[3-(hydroxymethyl)carbazol-9-yl]ethyl acetate (PubChem CID 143174420) has the molecular formula C17H17NO3 and a molecular weight of 283.33 g/mol. Its IUPAC name is 2-[3-(hydroxymethyl)carbazol-9-yl]ethyl acetate.

Molecular Properties

Compound Name2-[3-(hydroxymethyl)carbazol-9-yl]ethyl acetate
PubChem CID143174420
Molecular FormulaC17H17NO3
Molecular Weight283.33 g/mol
Exact Mass283.12
IUPAC Name2-[3-(hydroxymethyl)carbazol-9-yl]ethyl acetate
SMILESCC(=O)OCCn1c2ccccc2c2cc(CO)ccc21
InChIInChI=1S/C17H17NO3/c1-12(20)21-9-8-18-16-5-3-2-4-14(16)15-10-13(11-19)6-7-17(15)18/h2-7,10,19H,8-9,11H2,1H3
InChIKeyHTIDMEOAPABQMM-UHFFFAOYSA-N
XLogP2.85
TPSA51.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[9-(2-ethoxyethyl)carbazol-3-yl]methanol
CID 125496237
(9-dodecylcarbazol-3-yl)methanol
CID 151995019
2-[14-hydroxy-7-(hydroxymethyl)-3,13-diazahexacyclo[14.7.0.02,10.04,9.011,15.017,22]tricosa-1(16),2(10),4(9),5,7,11,14,17,19,21-decaen-3-yl]ethyl acetate
CID 91074342
[9-[4-[4-[3-(hydroxymethyl)carbazol-9-yl]phenyl]phenyl]carbazol-3-yl]methanol
CID 58625620
2-(1-hydroxy-3-oxoisoquinolin-2-yl)ethyl acetate
CID 54327845
2-(2-oxo-1,3-benzoxazol-3-yl)ethyl acetate
CID 142790595
ethane;2-(9-oxoacridin-10-yl)ethyl 2-methylprop-2-enoate;sulfane
CID 145481975
bis[2-(9-oxoacridin-10-yl)ethyl] (E)-but-2-enedioate
CID 146937858
[(2S)-2,6-di(carbazol-9-yl)hexyl] acetate
CID 101429766
2-(3-aminocarbazol-9-yl)ethanol;hydrochloride
CID 66915381
2-(2-oxoquinoxalin-1-yl)ethyl acetate
CID 175088435
ethane;9-propylcarbazole;(9-propylcarbazol-3-yl)methyl (E)-3-phenylprop-2-enoate
CID 158589869

Frequently Asked Questions

What is the IUPAC name of 2-[3-(hydroxymethyl)carbazol-9-yl]ethyl acetate?
The IUPAC name of 2-[3-(hydroxymethyl)carbazol-9-yl]ethyl acetate (CID 143174420) is 2-[3-(hydroxymethyl)carbazol-9-yl]ethyl acetate.
What is the SMILES notation for 2-[3-(hydroxymethyl)carbazol-9-yl]ethyl acetate?
The canonical SMILES for 2-[3-(hydroxymethyl)carbazol-9-yl]ethyl acetate is CC(=O)OCCn1c2ccccc2c2cc(CO)ccc21.
What is the InChIKey of 2-[3-(hydroxymethyl)carbazol-9-yl]ethyl acetate?
The InChIKey is HTIDMEOAPABQMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO3/c1-12(20)21-9-8-18-16-5-3-2-4-14(16)15-10-13(11-19)6-7-17(15)18/h2-7,10,19H,8-9,11H2,1H3.
What are the key properties of 2-[3-(hydroxymethyl)carbazol-9-yl]ethyl acetate?
2-[3-(hydroxymethyl)carbazol-9-yl]ethyl acetate has a molecular weight of 283.33 g/mol, XLogP of 2.85, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(hydroxymethyl)carbazol-9-yl]ethyl acetate is sourced from PubChem (CID 143174420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).