cyclopropyl-[4-[4-(6-methoxyquinolin-7-yl)phenoxy]piperidin-1-yl]methanone

C25H26N2O3 — CID 155010934

IUPACcyclopropyl-[4-[4-(6-methoxyquinolin-7-yl)phenoxy]piperidin-1-yl]methanone
SMILESCOc1cc2cccnc2cc1-c1ccc(OC2CCN(C(=O)C3CC3)CC2)cc1
InChIInChI=1S/C25H26N2O3/c1-29-24-15-19-3-2-12-26-23(19)16-22(24)17-6-8-20(9-7-17)30-21-10-13-27(14-11-21)25(28)18-4-5-18/h2-3,6-9,12,15-16,18,21H,4-5,10-11,13-14H2,1H3
InChIKeyNSDKUOXBFGTVAI-UHFFFAOYSA-N
MW402.49 g/mol
LogP4.69
Rot. Bonds5

About cyclopropyl-[4-[4-(6-methoxyquinolin-7-yl)phenoxy]piperidin-1-yl]methanone

cyclopropyl-[4-[4-(6-methoxyquinolin-7-yl)phenoxy]piperidin-1-yl]methanone (PubChem CID 155010934) has the molecular formula C25H26N2O3 and a molecular weight of 402.49 g/mol. Its IUPAC name is cyclopropyl-[4-[4-(6-methoxyquinolin-7-yl)phenoxy]piperidin-1-yl]methanone.

Molecular Properties

Compound Namecyclopropyl-[4-[4-(6-methoxyquinolin-7-yl)phenoxy]piperidin-1-yl]methanone
PubChem CID155010934
Molecular FormulaC25H26N2O3
Molecular Weight402.49 g/mol
Exact Mass402.19
IUPAC Namecyclopropyl-[4-[4-(6-methoxyquinolin-7-yl)phenoxy]piperidin-1-yl]methanone
SMILESCOc1cc2cccnc2cc1-c1ccc(OC2CCN(C(=O)C3CC3)CC2)cc1
InChIInChI=1S/C25H26N2O3/c1-29-24-15-19-3-2-12-26-23(19)16-22(24)17-6-8-20(9-7-17)30-21-10-13-27(14-11-21)25(28)18-4-5-18/h2-3,6-9,12,15-16,18,21H,4-5,10-11,13-14H2,1H3
InChIKeyNSDKUOXBFGTVAI-UHFFFAOYSA-N
XLogP4.69
TPSA51.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.49
LogP ≤ 54.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze cyclopropyl-[4-[4-(6-methoxyquinolin-7-yl)phenoxy]piperidin-1-yl]methanone with MolForge

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Related Compounds

cyclopropyl-[4-[4-(5-methylquinolin-7-yl)phenoxy]piperidin-1-yl]methanone;hydrochloride
CID 156702415
cyclopropyl-[4-(4-methoxyphenoxy)piperidin-1-yl]methanone
CID 110396800
1-[4-[4-[6-(2-pyrrolidin-1-ylethylamino)quinolin-7-yl]phenoxy]piperidin-1-yl]propan-1-one
CID 155010954
cyclopropyl-[4-[4-[8-(2-pyrrolidin-1-ylethoxy)quinolin-7-yl]phenoxy]piperidin-1-yl]methanone;hydrochloride
CID 156702483
[4-[[4-(6-chloroquinolin-7-yl)phenyl]methyl]piperidin-1-yl]-cyclopropylmethanone
CID 155337461
cyclopropyl-[4-[4-(3-methylisoquinolin-6-yl)phenoxy]piperidin-1-yl]methanone
CID 163996154
N-[4-[4-(1-methylpiperidin-4-yl)oxyphenyl]phenyl]quinoline-6-carboxamide
CID 118063587
1-[4-[2-fluoro-4-(6-methylquinolin-7-yl)phenoxy]piperidin-1-yl]propan-1-one
CID 155010909
1-[4-(4-quinolin-3-ylphenoxy)piperidin-1-yl]ethanone;hydrochloride
CID 156702413
1-(4-methoxyphenyl)-4-(4-pyrimidin-2-yloxypiperidine-1-carbonyl)pyrrolidin-2-one
CID 90558754
7-[4-(1-propanoylpiperidin-4-yl)oxyphenyl]quinoline-8-carboxylic acid
CID 142800445
(8-methoxy-3,4-dihydro-2H-chromen-3-yl)-(4-pyrimidin-2-yloxypiperidin-1-yl)methanone
CID 72871709

Frequently Asked Questions

What is the IUPAC name of cyclopropyl-[4-[4-(6-methoxyquinolin-7-yl)phenoxy]piperidin-1-yl]methanone?
The IUPAC name of cyclopropyl-[4-[4-(6-methoxyquinolin-7-yl)phenoxy]piperidin-1-yl]methanone (CID 155010934) is cyclopropyl-[4-[4-(6-methoxyquinolin-7-yl)phenoxy]piperidin-1-yl]methanone.
What is the SMILES notation for cyclopropyl-[4-[4-(6-methoxyquinolin-7-yl)phenoxy]piperidin-1-yl]methanone?
The canonical SMILES for cyclopropyl-[4-[4-(6-methoxyquinolin-7-yl)phenoxy]piperidin-1-yl]methanone is COc1cc2cccnc2cc1-c1ccc(OC2CCN(C(=O)C3CC3)CC2)cc1.
What is the InChIKey of cyclopropyl-[4-[4-(6-methoxyquinolin-7-yl)phenoxy]piperidin-1-yl]methanone?
The InChIKey is NSDKUOXBFGTVAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N2O3/c1-29-24-15-19-3-2-12-26-23(19)16-22(24)17-6-8-20(9-7-17)30-21-10-13-27(14-11-21)25(28)18-4-5-18/h2-3,6-9,12,15-16,18,21H,4-5,10-11,13-14H2,1H3.
What are the key properties of cyclopropyl-[4-[4-(6-methoxyquinolin-7-yl)phenoxy]piperidin-1-yl]methanone?
cyclopropyl-[4-[4-(6-methoxyquinolin-7-yl)phenoxy]piperidin-1-yl]methanone has a molecular weight of 402.49 g/mol, XLogP of 4.69, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-[4-[4-(6-methoxyquinolin-7-yl)phenoxy]piperidin-1-yl]methanone is sourced from PubChem (CID 155010934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).