2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]-9H-pyrrolo[2,3-b]carbazole

C25H20N2 — CID 145328023

IUPAC2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]-9H-pyrrolo[2,3-b]carbazole
SMILESC=Cc1c(/C=C\C)c2cc3c(cc2n1-c1ccccc1)[nH]c1ccccc13
InChIInChI=1S/C25H20N2/c1-3-10-19-21-15-20-18-13-8-9-14-22(18)26-23(20)16-25(21)27(24(19)4-2)17-11-6-5-7-12-17/h3-16,26H,2H2,1H3/b10-3-
InChIKeyPSGSMRDIZLKRLO-KMKOMSMNSA-N
MW348.45 g/mol
LogP6.94
Rot. Bonds3

About 2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]-9H-pyrrolo[2,3-b]carbazole

2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]-9H-pyrrolo[2,3-b]carbazole (PubChem CID 145328023) has the molecular formula C25H20N2 and a molecular weight of 348.45 g/mol. Its IUPAC name is 2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]-9H-pyrrolo[2,3-b]carbazole.

Molecular Properties

Compound Name2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]-9H-pyrrolo[2,3-b]carbazole
PubChem CID145328023
Molecular FormulaC25H20N2
Molecular Weight348.45 g/mol
Exact Mass348.16
IUPAC Name2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]-9H-pyrrolo[2,3-b]carbazole
SMILESC=Cc1c(/C=C\C)c2cc3c(cc2n1-c1ccccc1)[nH]c1ccccc13
InChIInChI=1S/C25H20N2/c1-3-10-19-21-15-20-18-13-8-9-14-22(18)26-23(20)16-25(21)27(24(19)4-2)17-11-6-5-7-12-17/h3-16,26H,2H2,1H3/b10-3-
InChIKeyPSGSMRDIZLKRLO-KMKOMSMNSA-N
XLogP6.94
TPSA20.72 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500348.45
LogP ≤ 56.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

ethane;2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]indole
CID 176690298
1-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-ethenyl-9-phenyl-3-[(Z)-prop-1-enyl]pyrrolo[2,3-b]carbazole
CID 138534156
2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]-5,10-dihydro-4H-pyrrolo[2,3-a]carbazole;molecular hydrogen
CID 156643246
2-ethenyl-1,10-diphenyl-3-[(Z)-prop-1-enyl]pyrrolo[2,3-a]carbazole
CID 138736833
11,19-diphenyl-11,15,19-triazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene
CID 139504800
9-(3,5-dibromophenyl)-3-[2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]indol-5-yl]carbazole
CID 145163222
9-[3-[3-[2-ethenyl-3-[(Z)-prop-1-enyl]indol-1-yl]phenyl]phenyl]carbazole
CID 89315996
N-[4-[4-(N-[2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]indol-5-yl]-4-methylanilino)phenyl]phenyl]-N-(4-methylphenyl)-9-phenylcarbazol-3-amine
CID 130309344
5-(9H-carbazol-3-yl)-7-phenylindolo[2,3-b]carbazole;(3Z,5Z)-hepta-1,3,5-triene
CID 145396754
13-ethenyl-9,14,23-triphenyl-12-[(Z)-prop-1-enyl]-9,14,23-triazahexacyclo[14.7.0.02,10.03,8.011,15.017,22]tricosa-1,3,5,7,10,12,15,17,19,21-decaene
CID 144536744
11-phenyl-11,15,20-triazaheptacyclo[15.11.0.02,14.04,12.05,10.019,27.021,26]octacosa-1(17),2(14),3,5,7,9,12,18,21,23,25,27-dodecaen-16-one
CID 168933239
[4-[2-ethenyl-3-[(Z)-prop-1-enyl]indol-1-yl]phenyl]boronic acid
CID 167453480

Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]-9H-pyrrolo[2,3-b]carbazole?
The IUPAC name of 2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]-9H-pyrrolo[2,3-b]carbazole (CID 145328023) is 2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]-9H-pyrrolo[2,3-b]carbazole.
What is the SMILES notation for 2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]-9H-pyrrolo[2,3-b]carbazole?
The canonical SMILES for 2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]-9H-pyrrolo[2,3-b]carbazole is C=Cc1c(/C=C\C)c2cc3c(cc2n1-c1ccccc1)[nH]c1ccccc13.
What is the InChIKey of 2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]-9H-pyrrolo[2,3-b]carbazole?
The InChIKey is PSGSMRDIZLKRLO-KMKOMSMNSA-N. The full InChI is InChI=1S/C25H20N2/c1-3-10-19-21-15-20-18-13-8-9-14-22(18)26-23(20)16-25(21)27(24(19)4-2)17-11-6-5-7-12-17/h3-16,26H,2H2,1H3/b10-3-.
What are the key properties of 2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]-9H-pyrrolo[2,3-b]carbazole?
2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]-9H-pyrrolo[2,3-b]carbazole has a molecular weight of 348.45 g/mol, XLogP of 6.94, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]-9H-pyrrolo[2,3-b]carbazole is sourced from PubChem (CID 145328023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).