4-methyl-4,5-dihydro-3H-[1]benzofuro[3,2-c]carbazole

C19H15NO — CID 144660792

IUPAC4-methyl-4,5-dihydro-3H-[1]benzofuro[3,2-c]carbazole
SMILESCC1CC=Cc2c1[nH]c1ccc3c4ccccc4oc3c21
InChIInChI=1S/C19H15NO/c1-11-5-4-7-14-17-15(20-18(11)14)10-9-13-12-6-2-3-8-16(12)21-19(13)17/h2-4,6-11,20H,5H2,1H3
InChIKeyMQRCFJMDDJWHKZ-UHFFFAOYSA-N
MW273.33 g/mol
LogP5.59
Rot. Bonds

About 4-methyl-4,5-dihydro-3H-[1]benzofuro[3,2-c]carbazole

4-methyl-4,5-dihydro-3H-[1]benzofuro[3,2-c]carbazole (PubChem CID 144660792) has the molecular formula C19H15NO and a molecular weight of 273.33 g/mol. Its IUPAC name is 4-methyl-4,5-dihydro-3H-[1]benzofuro[3,2-c]carbazole.

Molecular Properties

Compound Name4-methyl-4,5-dihydro-3H-[1]benzofuro[3,2-c]carbazole
PubChem CID144660792
Molecular FormulaC19H15NO
Molecular Weight273.33 g/mol
Exact Mass273.12
IUPAC Name4-methyl-4,5-dihydro-3H-[1]benzofuro[3,2-c]carbazole
SMILESCC1CC=Cc2c1[nH]c1ccc3c4ccccc4oc3c21
InChIInChI=1S/C19H15NO/c1-11-5-4-7-14-17-15(20-18(11)14)10-9-13-12-6-2-3-8-16(12)21-19(13)17/h2-4,6-11,20H,5H2,1H3
InChIKeyMQRCFJMDDJWHKZ-UHFFFAOYSA-N
XLogP5.59
TPSA28.93 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500273.33
LogP ≤ 55.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,5-dihydro-1H-[1]benzofuro[3,2-c]carbazole
CID 71234962
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
9-methyl-5-N,18-N-dinaphthalen-2-yl-5-N,18-N-diphenyl-21-oxapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8(13),11,15(20),16,18-nonaene-5,18-diamine
CID 121275552
12H-[1]benzofuro[2,3-a]carbazole;ethane
CID 145125553
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-(3-methylcyclohexa-2,4-dien-1-yl)dibenzofuran
CID 142397321
N-(1-methyl-1,2-dihydrophenanthren-9-yl)-N-[4-(10-phenylphenanthren-9-yl)phenyl]dibenzofuran-4-amine
CID 167008178
19-methyl-10,14-dioxapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1(13),2,4,6,8,11,15(20),16-octaene
CID 163622526
5-methyl-4-propan-2-yl-[1]benzofuro[3,2-c]carbazole
CID 169028023
31-oxa-1,5-diazadodecacyclo[22.17.1.15,16.02,23.04,21.06,15.09,14.028,42.029,41.030,38.032,37.020,43]tritetraconta-2(23),3,6(15),7,9,11,13,16,18,20(43),21,24(42),25,27,29(41),30(38),32,34,36,39-icosaene
CID 162480140
12-oxa-1,38-diazadodecacyclo[21.18.1.127,31.02,14.05,13.06,11.015,42.016,21.024,41.026,39.032,37.038,43]tritetraconta-2(14),3,5(13),6,8,10,15(42),16,18,20,22,24(41),25,27,29,31(43),32,34,36,39-icosaene
CID 162480187
2,4,6-tris(naphtho[1,2-b][1]benzofuran-1-yl)-1,3,5-triazine
CID 146658795

Frequently Asked Questions

What is the IUPAC name of 4-methyl-4,5-dihydro-3H-[1]benzofuro[3,2-c]carbazole?
The IUPAC name of 4-methyl-4,5-dihydro-3H-[1]benzofuro[3,2-c]carbazole (CID 144660792) is 4-methyl-4,5-dihydro-3H-[1]benzofuro[3,2-c]carbazole.
What is the SMILES notation for 4-methyl-4,5-dihydro-3H-[1]benzofuro[3,2-c]carbazole?
The canonical SMILES for 4-methyl-4,5-dihydro-3H-[1]benzofuro[3,2-c]carbazole is CC1CC=Cc2c1[nH]c1ccc3c4ccccc4oc3c21.
What is the InChIKey of 4-methyl-4,5-dihydro-3H-[1]benzofuro[3,2-c]carbazole?
The InChIKey is MQRCFJMDDJWHKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15NO/c1-11-5-4-7-14-17-15(20-18(11)14)10-9-13-12-6-2-3-8-16(12)21-19(13)17/h2-4,6-11,20H,5H2,1H3.
What are the key properties of 4-methyl-4,5-dihydro-3H-[1]benzofuro[3,2-c]carbazole?
4-methyl-4,5-dihydro-3H-[1]benzofuro[3,2-c]carbazole has a molecular weight of 273.33 g/mol, XLogP of 5.59, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-4,5-dihydro-3H-[1]benzofuro[3,2-c]carbazole is sourced from PubChem (CID 144660792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).