8-methyldibenzofuran-2-carbonitrile

C14H9NO — CID 118232593

IUPAC8-methyldibenzofuran-2-carbonitrile
SMILESCc1ccc2oc3ccc(C#N)cc3c2c1
InChIInChI=1S/C14H9NO/c1-9-2-4-13-11(6-9)12-7-10(8-15)3-5-14(12)16-13/h2-7H,1H3
InChIKeyVZNWFBOIXABBAL-UHFFFAOYSA-N
MW207.23 g/mol
LogP3.77
Rot. Bonds

About 8-methyldibenzofuran-2-carbonitrile

8-methyldibenzofuran-2-carbonitrile (PubChem CID 118232593) has the molecular formula C14H9NO and a molecular weight of 207.23 g/mol. Its IUPAC name is 8-methyldibenzofuran-2-carbonitrile.

Molecular Properties

Compound Name8-methyldibenzofuran-2-carbonitrile
PubChem CID118232593
Molecular FormulaC14H9NO
Molecular Weight207.23 g/mol
Exact Mass207.07
IUPAC Name8-methyldibenzofuran-2-carbonitrile
SMILESCc1ccc2oc3ccc(C#N)cc3c2c1
InChIInChI=1S/C14H9NO/c1-9-2-4-13-11(6-9)12-7-10(8-15)3-5-14(12)16-13/h2-7H,1H3
InChIKeyVZNWFBOIXABBAL-UHFFFAOYSA-N
XLogP3.77
TPSA36.93 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.23
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

8-fluorodibenzofuran-2-carbonitrile
CID 153329356
9-[8-(3-cyano-6-isocyanocarbazol-9-yl)dibenzofuran-2-yl]-6-methylcarbazole-3-carbonitrile
CID 162022797
3-hydroxy-5-methyl-1-benzofuran-2-carbonitrile
CID 13282141
8-cyanodibenzofuran-2-carboxamide
CID 69260878
4-[16-(4-cyanophenyl)-10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1(13),2,4(9),5,7,11,14(19),15,17-nonaen-6-yl]benzonitrile
CID 70854772
6-methyl-2-oxochromene-4-carbonitrile
CID 12820495
3-[amino-(3,5-dimethyl-1-benzofuran-2-yl)methyl]benzonitrile
CID 63990555
9-[8-(3-cyanocarbazol-9-yl)dibenzofuran-2-yl]carbazole-3-carbonitrile
CID 118386470
9-(8-carbazol-9-yldibenzofuran-2-yl)carbazole-3,6-dicarbonitrile
CID 118396755
actinium;8-methyldibenzofuran-2-ol
CID 18739071
2-methyl-8-(7-methyldibenzofuran-2-yl)dibenzofuran
CID 59359477
6-methyl-9-[4,6,8-tris(3-cyano-6-methylcarbazol-9-yl)dibenzofuran-2-yl]carbazole-3-carbonitrile
CID 134343685

Frequently Asked Questions

What is the IUPAC name of 8-methyldibenzofuran-2-carbonitrile?
The IUPAC name of 8-methyldibenzofuran-2-carbonitrile (CID 118232593) is 8-methyldibenzofuran-2-carbonitrile.
What is the SMILES notation for 8-methyldibenzofuran-2-carbonitrile?
The canonical SMILES for 8-methyldibenzofuran-2-carbonitrile is Cc1ccc2oc3ccc(C#N)cc3c2c1.
What is the InChIKey of 8-methyldibenzofuran-2-carbonitrile?
The InChIKey is VZNWFBOIXABBAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9NO/c1-9-2-4-13-11(6-9)12-7-10(8-15)3-5-14(12)16-13/h2-7H,1H3.
What are the key properties of 8-methyldibenzofuran-2-carbonitrile?
8-methyldibenzofuran-2-carbonitrile has a molecular weight of 207.23 g/mol, XLogP of 3.77, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyldibenzofuran-2-carbonitrile is sourced from PubChem (CID 118232593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).