8-methyl-4-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylpropoxy)-2,3-dihydro-1H-cyclopenta[c]quinoline

C24H33N3O — CID 135194523

IUPAC8-methyl-4-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylpropoxy)-2,3-dihydro-1H-cyclopenta[c]quinoline
SMILESCc1cc2c3c(c(N4CCCC4)nc2cc1OCCCN1CCCC1)CCC3
InChIInChI=1S/C24H33N3O/c1-18-16-21-19-8-6-9-20(19)24(27-13-4-5-14-27)25-22(21)17-23(18)28-15-7-12-26-10-2-3-11-26/h16-17H,2-15H2,1H3
InChIKeyQBDLAVJEIUZLIF-UHFFFAOYSA-N
MW379.55 g/mol
LogP4.50
Rot. Bonds6

About 8-methyl-4-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylpropoxy)-2,3-dihydro-1H-cyclopenta[c]quinoline

8-methyl-4-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylpropoxy)-2,3-dihydro-1H-cyclopenta[c]quinoline (PubChem CID 135194523) has the molecular formula C24H33N3O and a molecular weight of 379.55 g/mol. Its IUPAC name is 8-methyl-4-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylpropoxy)-2,3-dihydro-1H-cyclopenta[c]quinoline.

Molecular Properties

Compound Name8-methyl-4-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylpropoxy)-2,3-dihydro-1H-cyclopenta[c]quinoline
PubChem CID135194523
Molecular FormulaC24H33N3O
Molecular Weight379.55 g/mol
Exact Mass379.26
IUPAC Name8-methyl-4-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylpropoxy)-2,3-dihydro-1H-cyclopenta[c]quinoline
SMILESCc1cc2c3c(c(N4CCCC4)nc2cc1OCCCN1CCCC1)CCC3
InChIInChI=1S/C24H33N3O/c1-18-16-21-19-8-6-9-20(19)24(27-13-4-5-14-27)25-22(21)17-23(18)28-15-7-12-26-10-2-3-11-26/h16-17H,2-15H2,1H3
InChIKeyQBDLAVJEIUZLIF-UHFFFAOYSA-N
XLogP4.50
TPSA28.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.55
LogP ≤ 54.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-methyl-3-(3-pyrrolidin-1-ylpropoxy)-N-(2,2,2-trifluoroethyl)-7,8,9,10-tetrahydrophenanthridin-6-amine
CID 135194579
N-(2-deuteriopropan-2-yl)-8-methyl-7-(3-pyrrolidin-1-ylpropoxy)-2,3-dihydro-1H-cyclopenta[c]quinolin-4-amine
CID 147534886
N,8-dimethyl-N-phenyl-7-(3-pyrrolidin-1-ylpropoxy)-2,3-dihydro-1H-cyclopenta[c]quinolin-4-amine
CID 135194580
N-[(1R)-1-cyclobutylethyl]-8-methyl-7-(3-pyrrolidin-1-ylpropoxy)-2,3-dihydro-1H-cyclopenta[c]quinolin-4-amine
CID 135194635
N-ethyl-8-methoxy-7-(3-pyrrolidin-1-ylpropoxy)-2,3-dihydro-1H-cyclopenta[c]quinolin-4-amine
CID 135185248
8-methoxy-N-(2-methylpropyl)-7-(3-pyrrolidin-1-ylpropoxy)-2,3-dihydro-1H-cyclopenta[c]quinolin-4-amine
CID 135185023
N-ethyl-3,9-dimethyl-8-(3-pyrrolidin-1-ylpropoxy)-3,4-dihydro-1H-pyrano[4,3-c]quinolin-5-amine
CID 135194673
6-methoxy-4-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylpropoxy)quinazolin-2-amine
CID 177382773
8-methoxy-N-(1-methylcyclopropyl)-7-(3-pyrrolidin-1-ylpropoxy)-2,3-dihydro-1H-cyclopenta[c]quinolin-4-amine
CID 135185060
N-[8-methoxy-7-(3-pyrrolidin-1-ylpropoxy)-2,3-dihydro-1H-cyclopenta[c]quinolin-4-yl]acetamide
CID 135185225
4-(4-fluorocyclohexyl)-8-methoxy-7-(3-pyrrolidin-1-ylpropoxy)-2,3-dihydro-1H-cyclopenta[c]quinoline
CID 135185179
8-methoxy-7-(3-pyrrolidin-1-ylpropoxy)-2,3-dihydro-1H-cyclopenta[c]quinoline
CID 135155449

Frequently Asked Questions

What is the IUPAC name of 8-methyl-4-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylpropoxy)-2,3-dihydro-1H-cyclopenta[c]quinoline?
The IUPAC name of 8-methyl-4-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylpropoxy)-2,3-dihydro-1H-cyclopenta[c]quinoline (CID 135194523) is 8-methyl-4-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylpropoxy)-2,3-dihydro-1H-cyclopenta[c]quinoline.
What is the SMILES notation for 8-methyl-4-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylpropoxy)-2,3-dihydro-1H-cyclopenta[c]quinoline?
The canonical SMILES for 8-methyl-4-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylpropoxy)-2,3-dihydro-1H-cyclopenta[c]quinoline is Cc1cc2c3c(c(N4CCCC4)nc2cc1OCCCN1CCCC1)CCC3.
What is the InChIKey of 8-methyl-4-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylpropoxy)-2,3-dihydro-1H-cyclopenta[c]quinoline?
The InChIKey is QBDLAVJEIUZLIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H33N3O/c1-18-16-21-19-8-6-9-20(19)24(27-13-4-5-14-27)25-22(21)17-23(18)28-15-7-12-26-10-2-3-11-26/h16-17H,2-15H2,1H3.
What are the key properties of 8-methyl-4-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylpropoxy)-2,3-dihydro-1H-cyclopenta[c]quinoline?
8-methyl-4-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylpropoxy)-2,3-dihydro-1H-cyclopenta[c]quinoline has a molecular weight of 379.55 g/mol, XLogP of 4.50, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-4-pyrrolidin-1-yl-7-(3-pyrrolidin-1-ylpropoxy)-2,3-dihydro-1H-cyclopenta[c]quinoline is sourced from PubChem (CID 135194523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).