2-prop-2-enoxy-1-[(E)-prop-1-enyl]-9H-carbazole

C18H17NO — CID 102292352

IUPAC2-prop-2-enoxy-1-[(E)-prop-1-enyl]-9H-carbazole
SMILESC=CCOc1ccc2c([nH]c3ccccc32)c1/C=C/C
InChIInChI=1S/C18H17NO/c1-3-7-15-17(20-12-4-2)11-10-14-13-8-5-6-9-16(13)19-18(14)15/h3-11,19H,2,12H2,1H3/b7-3+
InChIKeyGABWFVWLKPISGH-XVNBXDOJSA-N
MW263.34 g/mol
LogP4.92
Rot. Bonds4

About 2-prop-2-enoxy-1-[(E)-prop-1-enyl]-9H-carbazole

2-prop-2-enoxy-1-[(E)-prop-1-enyl]-9H-carbazole (PubChem CID 102292352) has the molecular formula C18H17NO and a molecular weight of 263.34 g/mol. Its IUPAC name is 2-prop-2-enoxy-1-[(E)-prop-1-enyl]-9H-carbazole.

Molecular Properties

Compound Name2-prop-2-enoxy-1-[(E)-prop-1-enyl]-9H-carbazole
PubChem CID102292352
Molecular FormulaC18H17NO
Molecular Weight263.34 g/mol
Exact Mass263.13
IUPAC Name2-prop-2-enoxy-1-[(E)-prop-1-enyl]-9H-carbazole
SMILESC=CCOc1ccc2c([nH]c3ccccc32)c1/C=C/C
InChIInChI=1S/C18H17NO/c1-3-7-15-17(20-12-4-2)11-10-14-13-8-5-6-9-16(13)19-18(14)15/h3-11,19H,2,12H2,1H3/b7-3+
InChIKeyGABWFVWLKPISGH-XVNBXDOJSA-N
XLogP4.92
TPSA25.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 54.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

ethene;2-ethenyl-3-[(Z)-prop-1-enyl]-1,10-dihydropyrrolo[2,3-a]carbazole;methane
CID 145126089
benzene;1,2-bis(ethenyl)-9H-carbazole
CID 170336625
1-(2-ethoxyphenyl)-9H-carbazole
CID 175136892
3-ethenyl-4-[(Z)-prop-1-enyl]-1H-1-benzazepine-2,5-dione
CID 143318864
1-(4-prop-1-enylphenyl)-9H-carbazole
CID 175584569
4-bromo-1-ethoxy-9H-carbazole
CID 69306295
4-ethenyl-5-[(Z)-prop-1-enyl]-3,9,19-triazapentacyclo[10.7.0.02,6.07,11.013,18]nonadeca-1,4,6,11,13,15,17-heptaene-8,10-dione
CID 142254198
3-methyl-1-(3-methylbut-2-enoxy)-9H-carbazole
CID 91493313
16-azahexacyclo[12.11.0.02,11.05,10.015,23.017,22]pentacosa-1(14),2(11),3,5,7,9,12,15(23),17,19,21,24-dodecaene
CID 86153881
ethane;3-ethenyl-2-[(Z)-prop-1-enyl]-1H-indole;3-propyl-9H-carbazole
CID 144821210
1-prop-1-enoxy-2-prop-2-enoxybenzene
CID 57352619
ethane;18,24,24-trimethyl-19-[(Z)-prop-1-enyl]-14-oxa-3,17-diazahexacyclo[11.11.0.02,10.04,9.015,23.016,20]tetracosa-1(13),2(10),4,6,8,11,15(23),16(20),18,21-decaene
CID 145243641

Frequently Asked Questions

What is the IUPAC name of 2-prop-2-enoxy-1-[(E)-prop-1-enyl]-9H-carbazole?
The IUPAC name of 2-prop-2-enoxy-1-[(E)-prop-1-enyl]-9H-carbazole (CID 102292352) is 2-prop-2-enoxy-1-[(E)-prop-1-enyl]-9H-carbazole.
What is the SMILES notation for 2-prop-2-enoxy-1-[(E)-prop-1-enyl]-9H-carbazole?
The canonical SMILES for 2-prop-2-enoxy-1-[(E)-prop-1-enyl]-9H-carbazole is C=CCOc1ccc2c([nH]c3ccccc32)c1/C=C/C.
What is the InChIKey of 2-prop-2-enoxy-1-[(E)-prop-1-enyl]-9H-carbazole?
The InChIKey is GABWFVWLKPISGH-XVNBXDOJSA-N. The full InChI is InChI=1S/C18H17NO/c1-3-7-15-17(20-12-4-2)11-10-14-13-8-5-6-9-16(13)19-18(14)15/h3-11,19H,2,12H2,1H3/b7-3+.
What are the key properties of 2-prop-2-enoxy-1-[(E)-prop-1-enyl]-9H-carbazole?
2-prop-2-enoxy-1-[(E)-prop-1-enyl]-9H-carbazole has a molecular weight of 263.34 g/mol, XLogP of 4.92, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-prop-2-enoxy-1-[(E)-prop-1-enyl]-9H-carbazole is sourced from PubChem (CID 102292352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).