3-methyl-2-[(Z)-prop-1-enyl]-1H-[1]benzofuro[2,3-g]indole

C18H15NO — CID 167453493

IUPAC3-methyl-2-[(Z)-prop-1-enyl]-1H-[1]benzofuro[2,3-g]indole
SMILESC/C=C\c1[nH]c2c(ccc3oc4ccccc4c32)c1C
InChIInChI=1S/C18H15NO/c1-3-6-14-11(2)12-9-10-16-17(18(12)19-14)13-7-4-5-8-15(13)20-16/h3-10,19H,1-2H3/b6-3-
InChIKeyGKOQCOZVIDTEPV-UTCJRWHESA-N
MW261.32 g/mol
LogP5.41
Rot. Bonds1

About 3-methyl-2-[(Z)-prop-1-enyl]-1H-[1]benzofuro[2,3-g]indole

3-methyl-2-[(Z)-prop-1-enyl]-1H-[1]benzofuro[2,3-g]indole (PubChem CID 167453493) has the molecular formula C18H15NO and a molecular weight of 261.32 g/mol. Its IUPAC name is 3-methyl-2-[(Z)-prop-1-enyl]-1H-[1]benzofuro[2,3-g]indole.

Molecular Properties

Compound Name3-methyl-2-[(Z)-prop-1-enyl]-1H-[1]benzofuro[2,3-g]indole
PubChem CID167453493
Molecular FormulaC18H15NO
Molecular Weight261.32 g/mol
Exact Mass261.12
IUPAC Name3-methyl-2-[(Z)-prop-1-enyl]-1H-[1]benzofuro[2,3-g]indole
SMILESC/C=C\c1[nH]c2c(ccc3oc4ccccc4c32)c1C
InChIInChI=1S/C18H15NO/c1-3-6-14-11(2)12-9-10-16-17(18(12)19-14)13-7-4-5-8-15(13)20-16/h3-10,19H,1-2H3/b6-3-
InChIKeyGKOQCOZVIDTEPV-UTCJRWHESA-N
XLogP5.41
TPSA28.93 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500261.32
LogP ≤ 55.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

12H-[1]benzofuro[3,2-a]carbazole;ethane
CID 167453025
ethane;3-ethenyl-1,1-dimethyl-2-[(Z)-prop-1-enyl]indeno[5,4-b][1]benzofuran
CID 142288841
9-(4-bromophenyl)-12H-[1]benzofuro[3,2-a]carbazole
CID 142742550
15-oxa-3-azapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,16,18,20-nonaen-14-one
CID 118248383
16,25-dimethyl-17,24-bis(2-methylphenyl)-6,35-dioxanonacyclo[25.11.0.02,14.05,13.07,12.015,20.021,26.028,36.029,34]octatriaconta-1(27),2(14),3,5(13),7,9,11,15(20),16,18,21(26),22,24,28(36),29,31,33,37-octadecaene
CID 146383205
2,3-dimethyl-1-benzofuran;ethane
CID 142047308
N-(2-bromodibenzofuran-1-yl)acetamide
CID 135334506
CID 174076879
CID 174076879
5-[2-ethenyl-1-[(Z)-prop-1-enyl]-[1]benzofuro[3,2-e][1]benzofuran-9-yl]-9,14-dioxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene
CID 167256599
2-[(1Z,3Z)-penta-1,3-dienyl]xanthen-9-one
CID 145218621
dibenzofuran;hydrofluoride
CID 158307405
dibenzofuran;hydrate
CID 70610865

Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-[(Z)-prop-1-enyl]-1H-[1]benzofuro[2,3-g]indole?
The IUPAC name of 3-methyl-2-[(Z)-prop-1-enyl]-1H-[1]benzofuro[2,3-g]indole (CID 167453493) is 3-methyl-2-[(Z)-prop-1-enyl]-1H-[1]benzofuro[2,3-g]indole.
What is the SMILES notation for 3-methyl-2-[(Z)-prop-1-enyl]-1H-[1]benzofuro[2,3-g]indole?
The canonical SMILES for 3-methyl-2-[(Z)-prop-1-enyl]-1H-[1]benzofuro[2,3-g]indole is C/C=C\c1[nH]c2c(ccc3oc4ccccc4c32)c1C.
What is the InChIKey of 3-methyl-2-[(Z)-prop-1-enyl]-1H-[1]benzofuro[2,3-g]indole?
The InChIKey is GKOQCOZVIDTEPV-UTCJRWHESA-N. The full InChI is InChI=1S/C18H15NO/c1-3-6-14-11(2)12-9-10-16-17(18(12)19-14)13-7-4-5-8-15(13)20-16/h3-10,19H,1-2H3/b6-3-.
What are the key properties of 3-methyl-2-[(Z)-prop-1-enyl]-1H-[1]benzofuro[2,3-g]indole?
3-methyl-2-[(Z)-prop-1-enyl]-1H-[1]benzofuro[2,3-g]indole has a molecular weight of 261.32 g/mol, XLogP of 5.41, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-[(Z)-prop-1-enyl]-1H-[1]benzofuro[2,3-g]indole is sourced from PubChem (CID 167453493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).