7-[2-(3-methylcyclopentyl)ethyl]-2,3-dihydro-1H-pyrrolo[2,3-b]quinoline

C19H24N2 — CID 153401880

IUPAC7-[2-(3-methylcyclopentyl)ethyl]-2,3-dihydro-1H-pyrrolo[2,3-b]quinoline
SMILESCC1CCC(CCc2ccc3cc4c(nc3c2)NCC4)C1
InChIInChI=1S/C19H24N2/c1-13-2-3-14(10-13)4-5-15-6-7-16-12-17-8-9-20-19(17)21-18(16)11-15/h6-7,11-14H,2-5,8-10H2,1H3,(H,20,21)
InChIKeyMHUXTZWFHPTQLQ-UHFFFAOYSA-N
MW280.42 g/mol
LogP4.57
Rot. Bonds3

About 7-[2-(3-methylcyclopentyl)ethyl]-2,3-dihydro-1H-pyrrolo[2,3-b]quinoline

7-[2-(3-methylcyclopentyl)ethyl]-2,3-dihydro-1H-pyrrolo[2,3-b]quinoline (PubChem CID 153401880) has the molecular formula C19H24N2 and a molecular weight of 280.42 g/mol. Its IUPAC name is 7-[2-(3-methylcyclopentyl)ethyl]-2,3-dihydro-1H-pyrrolo[2,3-b]quinoline.

Molecular Properties

Compound Name7-[2-(3-methylcyclopentyl)ethyl]-2,3-dihydro-1H-pyrrolo[2,3-b]quinoline
PubChem CID153401880
Molecular FormulaC19H24N2
Molecular Weight280.42 g/mol
Exact Mass280.19
IUPAC Name7-[2-(3-methylcyclopentyl)ethyl]-2,3-dihydro-1H-pyrrolo[2,3-b]quinoline
SMILESCC1CCC(CCc2ccc3cc4c(nc3c2)NCC4)C1
InChIInChI=1S/C19H24N2/c1-13-2-3-14(10-13)4-5-15-6-7-16-12-17-8-9-20-19(17)21-18(16)11-15/h6-7,11-14H,2-5,8-10H2,1H3,(H,20,21)
InChIKeyMHUXTZWFHPTQLQ-UHFFFAOYSA-N
XLogP4.57
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.42
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-[2-(3-methylcyclopentyl)ethyl]-2,3-dihydro-1H-pyrrolo[2,3-b]quinoline?
The IUPAC name of 7-[2-(3-methylcyclopentyl)ethyl]-2,3-dihydro-1H-pyrrolo[2,3-b]quinoline (CID 153401880) is 7-[2-(3-methylcyclopentyl)ethyl]-2,3-dihydro-1H-pyrrolo[2,3-b]quinoline.
What is the SMILES notation for 7-[2-(3-methylcyclopentyl)ethyl]-2,3-dihydro-1H-pyrrolo[2,3-b]quinoline?
The canonical SMILES for 7-[2-(3-methylcyclopentyl)ethyl]-2,3-dihydro-1H-pyrrolo[2,3-b]quinoline is CC1CCC(CCc2ccc3cc4c(nc3c2)NCC4)C1.
What is the InChIKey of 7-[2-(3-methylcyclopentyl)ethyl]-2,3-dihydro-1H-pyrrolo[2,3-b]quinoline?
The InChIKey is MHUXTZWFHPTQLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2/c1-13-2-3-14(10-13)4-5-15-6-7-16-12-17-8-9-20-19(17)21-18(16)11-15/h6-7,11-14H,2-5,8-10H2,1H3,(H,20,21).
What are the key properties of 7-[2-(3-methylcyclopentyl)ethyl]-2,3-dihydro-1H-pyrrolo[2,3-b]quinoline?
7-[2-(3-methylcyclopentyl)ethyl]-2,3-dihydro-1H-pyrrolo[2,3-b]quinoline has a molecular weight of 280.42 g/mol, XLogP of 4.57, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[2-(3-methylcyclopentyl)ethyl]-2,3-dihydro-1H-pyrrolo[2,3-b]quinoline is sourced from PubChem (CID 153401880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).