2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl-[4-(morpholin-4-ylmethyl)piperidin-1-yl]methanone

C23H29N3O2 — CID 55735652

IUPAC2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl-[4-(morpholin-4-ylmethyl)piperidin-1-yl]methanone
SMILESO=C(c1c2c(nc3ccccc13)CCC2)N1CCC(CN2CCOCC2)CC1
InChIInChI=1S/C23H29N3O2/c27-23(26-10-8-17(9-11-26)16-25-12-14-28-15-13-25)22-18-4-1-2-6-20(18)24-21-7-3-5-19(21)22/h1-2,4,6,17H,3,5,7-16H2
InChIKeyHLUHRVUMOSKCIB-UHFFFAOYSA-N
MW379.50 g/mol
LogP2.91
Rot. Bonds3

About 2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl-[4-(morpholin-4-ylmethyl)piperidin-1-yl]methanone

2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl-[4-(morpholin-4-ylmethyl)piperidin-1-yl]methanone (PubChem CID 55735652) has the molecular formula C23H29N3O2 and a molecular weight of 379.50 g/mol. Its IUPAC name is 2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl-[4-(morpholin-4-ylmethyl)piperidin-1-yl]methanone.

Molecular Properties

Compound Name2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl-[4-(morpholin-4-ylmethyl)piperidin-1-yl]methanone
PubChem CID55735652
Molecular FormulaC23H29N3O2
Molecular Weight379.50 g/mol
Exact Mass379.23
IUPAC Name2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl-[4-(morpholin-4-ylmethyl)piperidin-1-yl]methanone
SMILESO=C(c1c2c(nc3ccccc13)CCC2)N1CCC(CN2CCOCC2)CC1
InChIInChI=1S/C23H29N3O2/c27-23(26-10-8-17(9-11-26)16-25-12-14-28-15-13-25)22-18-4-1-2-6-20(18)24-21-7-3-5-19(21)22/h1-2,4,6,17H,3,5,7-16H2
InChIKeyHLUHRVUMOSKCIB-UHFFFAOYSA-N
XLogP2.91
TPSA45.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.50
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl-[4-(morpholin-4-ylmethyl)piperidin-1-yl]methanone?
The IUPAC name of 2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl-[4-(morpholin-4-ylmethyl)piperidin-1-yl]methanone (CID 55735652) is 2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl-[4-(morpholin-4-ylmethyl)piperidin-1-yl]methanone.
What is the SMILES notation for 2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl-[4-(morpholin-4-ylmethyl)piperidin-1-yl]methanone?
The canonical SMILES for 2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl-[4-(morpholin-4-ylmethyl)piperidin-1-yl]methanone is O=C(c1c2c(nc3ccccc13)CCC2)N1CCC(CN2CCOCC2)CC1.
What is the InChIKey of 2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl-[4-(morpholin-4-ylmethyl)piperidin-1-yl]methanone?
The InChIKey is HLUHRVUMOSKCIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29N3O2/c27-23(26-10-8-17(9-11-26)16-25-12-14-28-15-13-25)22-18-4-1-2-6-20(18)24-21-7-3-5-19(21)22/h1-2,4,6,17H,3,5,7-16H2.
What are the key properties of 2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl-[4-(morpholin-4-ylmethyl)piperidin-1-yl]methanone?
2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl-[4-(morpholin-4-ylmethyl)piperidin-1-yl]methanone has a molecular weight of 379.50 g/mol, XLogP of 2.91, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl-[4-(morpholin-4-ylmethyl)piperidin-1-yl]methanone is sourced from PubChem (CID 55735652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).