morpholin-4-yl-[6-(3-piperidin-1-ylpropoxy)quinolin-2-yl]methanone

C22H29N3O3 — CID 11516523

IUPACmorpholin-4-yl-[6-(3-piperidin-1-ylpropoxy)quinolin-2-yl]methanone
SMILESO=C(c1ccc2cc(OCCCN3CCCCC3)ccc2n1)N1CCOCC1
InChIInChI=1S/C22H29N3O3/c26-22(25-12-15-27-16-13-25)21-7-5-18-17-19(6-8-20(18)23-21)28-14-4-11-24-9-2-1-3-10-24/h5-8,17H,1-4,9-16H2
InChIKeySIFLVWLGHDIXCD-UHFFFAOYSA-N
MW383.49 g/mol
LogP2.96
Rot. Bonds6

About morpholin-4-yl-[6-(3-piperidin-1-ylpropoxy)quinolin-2-yl]methanone

morpholin-4-yl-[6-(3-piperidin-1-ylpropoxy)quinolin-2-yl]methanone (PubChem CID 11516523) has the molecular formula C22H29N3O3 and a molecular weight of 383.49 g/mol. Its IUPAC name is morpholin-4-yl-[6-(3-piperidin-1-ylpropoxy)quinolin-2-yl]methanone.

Molecular Properties

Compound Namemorpholin-4-yl-[6-(3-piperidin-1-ylpropoxy)quinolin-2-yl]methanone
PubChem CID11516523
Molecular FormulaC22H29N3O3
Molecular Weight383.49 g/mol
Exact Mass383.22
IUPAC Namemorpholin-4-yl-[6-(3-piperidin-1-ylpropoxy)quinolin-2-yl]methanone
SMILESO=C(c1ccc2cc(OCCCN3CCCCC3)ccc2n1)N1CCOCC1
InChIInChI=1S/C22H29N3O3/c26-22(25-12-15-27-16-13-25)21-7-5-18-17-19(6-8-20(18)23-21)28-14-4-11-24-9-2-1-3-10-24/h5-8,17H,1-4,9-16H2
InChIKeySIFLVWLGHDIXCD-UHFFFAOYSA-N
XLogP2.96
TPSA54.90 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.49
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

(1,1-dioxo-1,4-thiazinan-4-yl)-[6-(3-piperidin-1-ylpropoxy)quinolin-2-yl]methanone
CID 11539264
(6-hydroxyquinolin-2-yl)-morpholin-4-ylmethanone
CID 146493098
[6-(3-morpholin-4-ylpropoxy)naphthalen-2-yl]-thiomorpholin-4-ylmethanone
CID 69069513
[4-(morpholine-4-carbonyl)-1,4-diazepan-1-yl]-[4-(3-piperidin-1-ylpropoxy)phenyl]methanone
CID 10389448
3,6-bis(4-piperidin-1-ylbutoxy)acridine
CID 20553482
[4-(3-piperidin-1-ylpropoxy)phenyl]-[4-(quinoxaline-2-carbonyl)piperazin-1-yl]methanone
CID 10005692
[6-(3-piperidin-1-ylpropoxy)quinolin-2-yl] N-[(3-fluorooxetan-3-yl)methyl]carbamate
CID 67317517
methyl 6-(3-piperidin-1-ylpropoxy)naphthalene-2-carboxylate
CID 58933893
phenyl-[4-(3-quinolin-6-yloxypropyl)piperazin-1-yl]methanone
CID 45272100
3-[3-(1,4-oxazepan-4-yl)propoxy]benzoic acid
CID 63075111
N-ethyl-6-(3-piperidin-1-ylpropoxy)naphthalene-2-carboxamide
CID 69070873
(4-methylpiperidin-1-yl)-[6-(3-piperidin-3-ylpropoxy)quinolin-2-yl]methanone
CID 67012303

Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl-[6-(3-piperidin-1-ylpropoxy)quinolin-2-yl]methanone?
The IUPAC name of morpholin-4-yl-[6-(3-piperidin-1-ylpropoxy)quinolin-2-yl]methanone (CID 11516523) is morpholin-4-yl-[6-(3-piperidin-1-ylpropoxy)quinolin-2-yl]methanone.
What is the SMILES notation for morpholin-4-yl-[6-(3-piperidin-1-ylpropoxy)quinolin-2-yl]methanone?
The canonical SMILES for morpholin-4-yl-[6-(3-piperidin-1-ylpropoxy)quinolin-2-yl]methanone is O=C(c1ccc2cc(OCCCN3CCCCC3)ccc2n1)N1CCOCC1.
What is the InChIKey of morpholin-4-yl-[6-(3-piperidin-1-ylpropoxy)quinolin-2-yl]methanone?
The InChIKey is SIFLVWLGHDIXCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H29N3O3/c26-22(25-12-15-27-16-13-25)21-7-5-18-17-19(6-8-20(18)23-21)28-14-4-11-24-9-2-1-3-10-24/h5-8,17H,1-4,9-16H2.
What are the key properties of morpholin-4-yl-[6-(3-piperidin-1-ylpropoxy)quinolin-2-yl]methanone?
morpholin-4-yl-[6-(3-piperidin-1-ylpropoxy)quinolin-2-yl]methanone has a molecular weight of 383.49 g/mol, XLogP of 2.96, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl-[6-(3-piperidin-1-ylpropoxy)quinolin-2-yl]methanone is sourced from PubChem (CID 11516523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).