4-(2-methylpropyl)-3H-pyrrolo[2,3-c]quinoline

C15H16N2 — CID 52952003

IUPAC4-(2-methylpropyl)-3H-pyrrolo[2,3-c]quinoline
SMILESCC(C)Cc1nc2ccccc2c2cc[nH]c12
InChIInChI=1S/C15H16N2/c1-10(2)9-14-15-12(7-8-16-15)11-5-3-4-6-13(11)17-14/h3-8,10,16H,9H2,1-2H3
InChIKeyLEWFRNLLNXKYJJ-UHFFFAOYSA-N
MW224.31 g/mol
LogP3.91
Rot. Bonds2

About 4-(2-methylpropyl)-3H-pyrrolo[2,3-c]quinoline

4-(2-methylpropyl)-3H-pyrrolo[2,3-c]quinoline (PubChem CID 52952003) has the molecular formula C15H16N2 and a molecular weight of 224.31 g/mol. Its IUPAC name is 4-(2-methylpropyl)-3H-pyrrolo[2,3-c]quinoline.

Molecular Properties

Compound Name4-(2-methylpropyl)-3H-pyrrolo[2,3-c]quinoline
PubChem CID52952003
Molecular FormulaC15H16N2
Molecular Weight224.31 g/mol
Exact Mass224.13
IUPAC Name4-(2-methylpropyl)-3H-pyrrolo[2,3-c]quinoline
SMILESCC(C)Cc1nc2ccccc2c2cc[nH]c12
InChIInChI=1S/C15H16N2/c1-10(2)9-14-15-12(7-8-16-15)11-5-3-4-6-13(11)17-14/h3-8,10,16H,9H2,1-2H3
InChIKeyLEWFRNLLNXKYJJ-UHFFFAOYSA-N
XLogP3.91
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-(2-methylpropyl)-3H-pyrrolo[2,3-c]quinoline?
The IUPAC name of 4-(2-methylpropyl)-3H-pyrrolo[2,3-c]quinoline (CID 52952003) is 4-(2-methylpropyl)-3H-pyrrolo[2,3-c]quinoline.
What is the SMILES notation for 4-(2-methylpropyl)-3H-pyrrolo[2,3-c]quinoline?
The canonical SMILES for 4-(2-methylpropyl)-3H-pyrrolo[2,3-c]quinoline is CC(C)Cc1nc2ccccc2c2cc[nH]c12.
What is the InChIKey of 4-(2-methylpropyl)-3H-pyrrolo[2,3-c]quinoline?
The InChIKey is LEWFRNLLNXKYJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2/c1-10(2)9-14-15-12(7-8-16-15)11-5-3-4-6-13(11)17-14/h3-8,10,16H,9H2,1-2H3.
What are the key properties of 4-(2-methylpropyl)-3H-pyrrolo[2,3-c]quinoline?
4-(2-methylpropyl)-3H-pyrrolo[2,3-c]quinoline has a molecular weight of 224.31 g/mol, XLogP of 3.91, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylpropyl)-3H-pyrrolo[2,3-c]quinoline is sourced from PubChem (CID 52952003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).