2,5-dihydro-1H-[1]benzofuro[3,2-c]carbazole

C18H13NO — CID 71234962

IUPAC2,5-dihydro-1H-[1]benzofuro[3,2-c]carbazole
SMILESC1=Cc2[nH]c3ccc4c5ccccc5oc4c3c2CC1
InChIInChI=1S/C18H13NO/c1-3-7-14-13(6-1)17-15(19-14)10-9-12-11-5-2-4-8-16(11)20-18(12)17/h2-5,7-10,19H,1,6H2
InChIKeyYAMPGGZZBKGDBL-UHFFFAOYSA-N
MW259.31 g/mol
LogP5.03
Rot. Bonds

About 2,5-dihydro-1H-[1]benzofuro[3,2-c]carbazole

2,5-dihydro-1H-[1]benzofuro[3,2-c]carbazole (PubChem CID 71234962) has the molecular formula C18H13NO and a molecular weight of 259.31 g/mol. Its IUPAC name is 2,5-dihydro-1H-[1]benzofuro[3,2-c]carbazole.

Molecular Properties

Compound Name2,5-dihydro-1H-[1]benzofuro[3,2-c]carbazole
PubChem CID71234962
Molecular FormulaC18H13NO
Molecular Weight259.31 g/mol
Exact Mass259.10
IUPAC Name2,5-dihydro-1H-[1]benzofuro[3,2-c]carbazole
SMILESC1=Cc2[nH]c3ccc4c5ccccc5oc4c3c2CC1
InChIInChI=1S/C18H13NO/c1-3-7-14-13(6-1)17-15(19-14)10-9-12-11-5-2-4-8-16(11)20-18(12)17/h2-5,7-10,19H,1,6H2
InChIKeyYAMPGGZZBKGDBL-UHFFFAOYSA-N
XLogP5.03
TPSA28.93 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500259.31
LogP ≤ 55.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4,25-dioxa-15-azaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.019,24]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19,21,23,26-dodecaene
CID 145347853
4-methyl-4,5-dihydro-3H-[1]benzofuro[3,2-c]carbazole
CID 144660792
3-oxa-23-azahexacyclo[11.11.0.02,10.04,9.016,24.017,22]tetracosa-1(13),2(10),4,6,8,11,14,16(24),17,19,21-undecaene
CID 90219451
4-[4-[8-[4-(8,9-dihydrodibenzofuran-4-yl)phenyl]pyren-1-yl]phenyl]dibenzofuran
CID 88912607
6-(5-dibenzofuran-2-yl-9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3(8),4,6,11,14(19),15,17-nonaen-16-yl)-9-phenyl-1,2-dihydrocarbazole
CID 163554857
5-(10-phenyl-1,2-dihydroanthracen-9-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14,16,18-nonaene
CID 174288134
1-(6,9-dihydro-5H-carbazol-2-yl)ethanone
CID 22294501
18-[4-[6-(7,8-dihydronaphthalen-2-yl)naphthalen-2-yl]phenyl]-3-oxapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,14,16(21),17,19-decaene
CID 123927159
11-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]-9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1,3(8),6,10,12,14,16,18-octaene
CID 88995013
12H-[1]benzofuro[2,3-a]carbazole;ethane
CID 145125553
5-chloro-9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3(8),4,6,11,14,16,18-nonaene
CID 135171594
7-[10-(2-phenylphenyl)-3,4-dihydroanthracen-9-yl]-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14,16,18-nonaene
CID 144583429

Frequently Asked Questions

What is the IUPAC name of 2,5-dihydro-1H-[1]benzofuro[3,2-c]carbazole?
The IUPAC name of 2,5-dihydro-1H-[1]benzofuro[3,2-c]carbazole (CID 71234962) is 2,5-dihydro-1H-[1]benzofuro[3,2-c]carbazole.
What is the SMILES notation for 2,5-dihydro-1H-[1]benzofuro[3,2-c]carbazole?
The canonical SMILES for 2,5-dihydro-1H-[1]benzofuro[3,2-c]carbazole is C1=Cc2[nH]c3ccc4c5ccccc5oc4c3c2CC1.
What is the InChIKey of 2,5-dihydro-1H-[1]benzofuro[3,2-c]carbazole?
The InChIKey is YAMPGGZZBKGDBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13NO/c1-3-7-14-13(6-1)17-15(19-14)10-9-12-11-5-2-4-8-16(11)20-18(12)17/h2-5,7-10,19H,1,6H2.
What are the key properties of 2,5-dihydro-1H-[1]benzofuro[3,2-c]carbazole?
2,5-dihydro-1H-[1]benzofuro[3,2-c]carbazole has a molecular weight of 259.31 g/mol, XLogP of 5.03, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dihydro-1H-[1]benzofuro[3,2-c]carbazole is sourced from PubChem (CID 71234962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).