7-[1-(cyclohexylmethyl)indol-2-yl]quinoline

C24H24N2 — CID 175958700

IUPAC7-[1-(cyclohexylmethyl)indol-2-yl]quinoline
SMILESc1cnc2cc(-c3cc4ccccc4n3CC3CCCCC3)ccc2c1
InChIInChI=1S/C24H24N2/c1-2-7-18(8-3-1)17-26-23-11-5-4-9-20(23)16-24(26)21-13-12-19-10-6-14-25-22(19)15-21/h4-6,9-16,18H,1-3,7-8,17H2
InChIKeyVXBSAXKDZWFHHP-UHFFFAOYSA-N
MW340.47 g/mol
LogP6.44
Rot. Bonds3

About 7-[1-(cyclohexylmethyl)indol-2-yl]quinoline

7-[1-(cyclohexylmethyl)indol-2-yl]quinoline (PubChem CID 175958700) has the molecular formula C24H24N2 and a molecular weight of 340.47 g/mol. Its IUPAC name is 7-[1-(cyclohexylmethyl)indol-2-yl]quinoline.

Molecular Properties

Compound Name7-[1-(cyclohexylmethyl)indol-2-yl]quinoline
PubChem CID175958700
Molecular FormulaC24H24N2
Molecular Weight340.47 g/mol
Exact Mass340.19
IUPAC Name7-[1-(cyclohexylmethyl)indol-2-yl]quinoline
SMILESc1cnc2cc(-c3cc4ccccc4n3CC3CCCCC3)ccc2c1
InChIInChI=1S/C24H24N2/c1-2-7-18(8-3-1)17-26-23-11-5-4-9-20(23)16-24(26)21-13-12-19-10-6-14-25-22(19)15-21/h4-6,9-16,18H,1-3,7-8,17H2
InChIKeyVXBSAXKDZWFHHP-UHFFFAOYSA-N
XLogP6.44
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500340.47
LogP ≤ 56.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-[1-(cyclohexylmethyl)indol-2-yl]quinoline?
The IUPAC name of 7-[1-(cyclohexylmethyl)indol-2-yl]quinoline (CID 175958700) is 7-[1-(cyclohexylmethyl)indol-2-yl]quinoline.
What is the SMILES notation for 7-[1-(cyclohexylmethyl)indol-2-yl]quinoline?
The canonical SMILES for 7-[1-(cyclohexylmethyl)indol-2-yl]quinoline is c1cnc2cc(-c3cc4ccccc4n3CC3CCCCC3)ccc2c1.
What is the InChIKey of 7-[1-(cyclohexylmethyl)indol-2-yl]quinoline?
The InChIKey is VXBSAXKDZWFHHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2/c1-2-7-18(8-3-1)17-26-23-11-5-4-9-20(23)16-24(26)21-13-12-19-10-6-14-25-22(19)15-21/h4-6,9-16,18H,1-3,7-8,17H2.
What are the key properties of 7-[1-(cyclohexylmethyl)indol-2-yl]quinoline?
7-[1-(cyclohexylmethyl)indol-2-yl]quinoline has a molecular weight of 340.47 g/mol, XLogP of 6.44, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[1-(cyclohexylmethyl)indol-2-yl]quinoline is sourced from PubChem (CID 175958700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).