2,3-dihydro-1H-cyclopenta[b]quinolin-7-yl-(4-methoxycyclohexyl)methanone

C20H23NO2 — CID 11483690

IUPAC2,3-dihydro-1H-cyclopenta[b]quinolin-7-yl-(4-methoxycyclohexyl)methanone
SMILESCOC1CCC(C(=O)c2ccc3nc4c(cc3c2)CCC4)CC1
InChIInChI=1S/C20H23NO2/c1-23-17-8-5-13(6-9-17)20(22)15-7-10-19-16(12-15)11-14-3-2-4-18(14)21-19/h7,10-13,17H,2-6,8-9H2,1H3
InChIKeyYFOGCTLEXPQNKV-UHFFFAOYSA-N
MW309.41 g/mol
LogP4.11
Rot. Bonds3

About 2,3-dihydro-1H-cyclopenta[b]quinolin-7-yl-(4-methoxycyclohexyl)methanone

2,3-dihydro-1H-cyclopenta[b]quinolin-7-yl-(4-methoxycyclohexyl)methanone (PubChem CID 11483690) has the molecular formula C20H23NO2 and a molecular weight of 309.41 g/mol. Its IUPAC name is 2,3-dihydro-1H-cyclopenta[b]quinolin-7-yl-(4-methoxycyclohexyl)methanone.

Molecular Properties

Compound Name2,3-dihydro-1H-cyclopenta[b]quinolin-7-yl-(4-methoxycyclohexyl)methanone
PubChem CID11483690
Molecular FormulaC20H23NO2
Molecular Weight309.41 g/mol
Exact Mass309.17
IUPAC Name2,3-dihydro-1H-cyclopenta[b]quinolin-7-yl-(4-methoxycyclohexyl)methanone
SMILESCOC1CCC(C(=O)c2ccc3nc4c(cc3c2)CCC4)CC1
InChIInChI=1S/C20H23NO2/c1-23-17-8-5-13(6-9-17)20(22)15-7-10-19-16(12-15)11-14-3-2-4-18(14)21-19/h7,10-13,17H,2-6,8-9H2,1H3
InChIKeyYFOGCTLEXPQNKV-UHFFFAOYSA-N
XLogP4.11
TPSA39.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 54.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-cyclopenta[b]quinolin-7-yl-(4-methoxycyclohexyl)methanone?
The IUPAC name of 2,3-dihydro-1H-cyclopenta[b]quinolin-7-yl-(4-methoxycyclohexyl)methanone (CID 11483690) is 2,3-dihydro-1H-cyclopenta[b]quinolin-7-yl-(4-methoxycyclohexyl)methanone.
What is the SMILES notation for 2,3-dihydro-1H-cyclopenta[b]quinolin-7-yl-(4-methoxycyclohexyl)methanone?
The canonical SMILES for 2,3-dihydro-1H-cyclopenta[b]quinolin-7-yl-(4-methoxycyclohexyl)methanone is COC1CCC(C(=O)c2ccc3nc4c(cc3c2)CCC4)CC1.
What is the InChIKey of 2,3-dihydro-1H-cyclopenta[b]quinolin-7-yl-(4-methoxycyclohexyl)methanone?
The InChIKey is YFOGCTLEXPQNKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO2/c1-23-17-8-5-13(6-9-17)20(22)15-7-10-19-16(12-15)11-14-3-2-4-18(14)21-19/h7,10-13,17H,2-6,8-9H2,1H3.
What are the key properties of 2,3-dihydro-1H-cyclopenta[b]quinolin-7-yl-(4-methoxycyclohexyl)methanone?
2,3-dihydro-1H-cyclopenta[b]quinolin-7-yl-(4-methoxycyclohexyl)methanone has a molecular weight of 309.41 g/mol, XLogP of 4.11, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-cyclopenta[b]quinolin-7-yl-(4-methoxycyclohexyl)methanone is sourced from PubChem (CID 11483690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).