prop-2-enyl 3-hydroxy-9H-carbazole-4-carboxylate

C16H13NO3 — CID 132510689

IUPACprop-2-enyl 3-hydroxy-9H-carbazole-4-carboxylate
SMILESC=CCOC(=O)c1c(O)ccc2[nH]c3ccccc3c12
InChIInChI=1S/C16H13NO3/c1-2-9-20-16(19)15-13(18)8-7-12-14(15)10-5-3-4-6-11(10)17-12/h2-8,17-18H,1,9H2
InChIKeyINNRECQAOXHXSP-UHFFFAOYSA-N
MW267.28 g/mol
LogP3.37
Rot. Bonds3

About prop-2-enyl 3-hydroxy-9H-carbazole-4-carboxylate

prop-2-enyl 3-hydroxy-9H-carbazole-4-carboxylate (PubChem CID 132510689) has the molecular formula C16H13NO3 and a molecular weight of 267.28 g/mol. Its IUPAC name is prop-2-enyl 3-hydroxy-9H-carbazole-4-carboxylate.

Molecular Properties

Compound Nameprop-2-enyl 3-hydroxy-9H-carbazole-4-carboxylate
PubChem CID132510689
Molecular FormulaC16H13NO3
Molecular Weight267.28 g/mol
Exact Mass267.09
IUPAC Nameprop-2-enyl 3-hydroxy-9H-carbazole-4-carboxylate
SMILESC=CCOC(=O)c1c(O)ccc2[nH]c3ccccc3c12
InChIInChI=1S/C16H13NO3/c1-2-9-20-16(19)15-13(18)8-7-12-14(15)10-5-3-4-6-11(10)17-12/h2-8,17-18H,1,9H2
InChIKeyINNRECQAOXHXSP-UHFFFAOYSA-N
XLogP3.37
TPSA62.32 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.28
LogP ≤ 53.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze prop-2-enyl 3-hydroxy-9H-carbazole-4-carboxylate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

prop-2-enyl 4-oxo-1H-quinoline-2-carboxylate
CID 67639122
9H-carbazole;prop-2-enamide
CID 174545742
bis(prop-2-enyl) naphthalene-1,2-dicarboxylate
CID 19710369
benzyl 2-prop-2-enoxy-1H-indole-3-carboxylate
CID 68573887
3-O-ethyl 4-O-prop-2-enyl 2-methylquinoline-3,4-dicarboxylate
CID 177389903
benzene-1,2-diol;bis(prop-2-enyl) carbonate
CID 23056283
bis(prop-2-enyl) benzene-1,2-dicarboxylate
CID 8560
prop-2-enyl 2-(1H-indol-3-yl)acetate
CID 14701449
bis(prop-2-enyl) benzene-1,2-dicarboxylate;hydron
CID 174523101
formic acid;prop-2-enyl benzoate
CID 174813743
prop-2-enyl 7-hydroxypyrido[1,2-a]indole-10-carboxylate
CID 66667210
3-ethyl-9H-carbazol-4-ol
CID 163569607

Frequently Asked Questions

What is the IUPAC name of prop-2-enyl 3-hydroxy-9H-carbazole-4-carboxylate?
The IUPAC name of prop-2-enyl 3-hydroxy-9H-carbazole-4-carboxylate (CID 132510689) is prop-2-enyl 3-hydroxy-9H-carbazole-4-carboxylate.
What is the SMILES notation for prop-2-enyl 3-hydroxy-9H-carbazole-4-carboxylate?
The canonical SMILES for prop-2-enyl 3-hydroxy-9H-carbazole-4-carboxylate is C=CCOC(=O)c1c(O)ccc2[nH]c3ccccc3c12.
What is the InChIKey of prop-2-enyl 3-hydroxy-9H-carbazole-4-carboxylate?
The InChIKey is INNRECQAOXHXSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13NO3/c1-2-9-20-16(19)15-13(18)8-7-12-14(15)10-5-3-4-6-11(10)17-12/h2-8,17-18H,1,9H2.
What are the key properties of prop-2-enyl 3-hydroxy-9H-carbazole-4-carboxylate?
prop-2-enyl 3-hydroxy-9H-carbazole-4-carboxylate has a molecular weight of 267.28 g/mol, XLogP of 3.37, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for prop-2-enyl 3-hydroxy-9H-carbazole-4-carboxylate is sourced from PubChem (CID 132510689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).