6-ethyl-7-methoxy-N-[1-(2-methoxyethyl)piperidin-4-yl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine

C23H33N3O2 — CID 166560652

IUPAC6-ethyl-7-methoxy-N-[1-(2-methoxyethyl)piperidin-4-yl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
SMILESCCc1cc2nc3c(c(NC4CCN(CCOC)CC4)c2cc1OC)CCC3
InChIInChI=1S/C23H33N3O2/c1-4-16-14-21-19(15-22(16)28-3)23(18-6-5-7-20(18)25-21)24-17-8-10-26(11-9-17)12-13-27-2/h14-15,17H,4-13H2,1-3H3,(H,24,25)
InChIKeyOBTBLRVNGCZSEV-UHFFFAOYSA-N
MW383.54 g/mol
LogP3.82
Rot. Bonds7

About 6-ethyl-7-methoxy-N-[1-(2-methoxyethyl)piperidin-4-yl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine

6-ethyl-7-methoxy-N-[1-(2-methoxyethyl)piperidin-4-yl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine (PubChem CID 166560652) has the molecular formula C23H33N3O2 and a molecular weight of 383.54 g/mol. Its IUPAC name is 6-ethyl-7-methoxy-N-[1-(2-methoxyethyl)piperidin-4-yl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine.

Molecular Properties

Compound Name6-ethyl-7-methoxy-N-[1-(2-methoxyethyl)piperidin-4-yl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
PubChem CID166560652
Molecular FormulaC23H33N3O2
Molecular Weight383.54 g/mol
Exact Mass383.26
IUPAC Name6-ethyl-7-methoxy-N-[1-(2-methoxyethyl)piperidin-4-yl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
SMILESCCc1cc2nc3c(c(NC4CCN(CCOC)CC4)c2cc1OC)CCC3
InChIInChI=1S/C23H33N3O2/c1-4-16-14-21-19(15-22(16)28-3)23(18-6-5-7-20(18)25-21)24-17-8-10-26(11-9-17)12-13-27-2/h14-15,17H,4-13H2,1-3H3,(H,24,25)
InChIKeyOBTBLRVNGCZSEV-UHFFFAOYSA-N
XLogP3.82
TPSA46.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.54
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-7-methoxy-N-[1-(2-methoxyethyl)piperidin-4-yl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
The IUPAC name of 6-ethyl-7-methoxy-N-[1-(2-methoxyethyl)piperidin-4-yl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine (CID 166560652) is 6-ethyl-7-methoxy-N-[1-(2-methoxyethyl)piperidin-4-yl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine.
What is the SMILES notation for 6-ethyl-7-methoxy-N-[1-(2-methoxyethyl)piperidin-4-yl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
The canonical SMILES for 6-ethyl-7-methoxy-N-[1-(2-methoxyethyl)piperidin-4-yl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine is CCc1cc2nc3c(c(NC4CCN(CCOC)CC4)c2cc1OC)CCC3.
What is the InChIKey of 6-ethyl-7-methoxy-N-[1-(2-methoxyethyl)piperidin-4-yl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
The InChIKey is OBTBLRVNGCZSEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H33N3O2/c1-4-16-14-21-19(15-22(16)28-3)23(18-6-5-7-20(18)25-21)24-17-8-10-26(11-9-17)12-13-27-2/h14-15,17H,4-13H2,1-3H3,(H,24,25).
What are the key properties of 6-ethyl-7-methoxy-N-[1-(2-methoxyethyl)piperidin-4-yl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
6-ethyl-7-methoxy-N-[1-(2-methoxyethyl)piperidin-4-yl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine has a molecular weight of 383.54 g/mol, XLogP of 3.82, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-7-methoxy-N-[1-(2-methoxyethyl)piperidin-4-yl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine is sourced from PubChem (CID 166560652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).