(4-chlorophenyl)-[4-(2-methoxyethyl)piperidin-1-yl]methanone

C15H20ClNO2 — CID 53150807

IUPAC(4-chlorophenyl)-[4-(2-methoxyethyl)piperidin-1-yl]methanone
SMILESCOCCC1CCN(C(=O)c2ccc(Cl)cc2)CC1
InChIInChI=1S/C15H20ClNO2/c1-19-11-8-12-6-9-17(10-7-12)15(18)13-2-4-14(16)5-3-13/h2-5,12H,6-11H2,1H3
InChIKeyQQAMVBRHXZVMPM-UHFFFAOYSA-N
MW281.78 g/mol
LogP3.23
Rot. Bonds4

About (4-chlorophenyl)-[4-(2-methoxyethyl)piperidin-1-yl]methanone

(4-chlorophenyl)-[4-(2-methoxyethyl)piperidin-1-yl]methanone (PubChem CID 53150807) has the molecular formula C15H20ClNO2 and a molecular weight of 281.78 g/mol. Its IUPAC name is (4-chlorophenyl)-[4-(2-methoxyethyl)piperidin-1-yl]methanone.

Molecular Properties

Compound Name(4-chlorophenyl)-[4-(2-methoxyethyl)piperidin-1-yl]methanone
PubChem CID53150807
Molecular FormulaC15H20ClNO2
Molecular Weight281.78 g/mol
Exact Mass281.12
IUPAC Name(4-chlorophenyl)-[4-(2-methoxyethyl)piperidin-1-yl]methanone
SMILESCOCCC1CCN(C(=O)c2ccc(Cl)cc2)CC1
InChIInChI=1S/C15H20ClNO2/c1-19-11-8-12-6-9-17(10-7-12)15(18)13-2-4-14(16)5-3-13/h2-5,12H,6-11H2,1H3
InChIKeyQQAMVBRHXZVMPM-UHFFFAOYSA-N
XLogP3.23
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.78
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(5-chloro-2-fluorophenyl)-[4-(2-methoxyethyl)piperidin-1-yl]methanone
CID 53150855
2-(4-chlorophenoxy)-1-[4-(2-methoxyethyl)piperidin-1-yl]propan-1-one
CID 53150906
N-[1-(4-chlorobenzoyl)piperidin-4-yl]-2-(2-methoxyethoxy)acetamide
CID 108557704
(4-chlorophenyl)-[4-[[(2R)-1-methoxybutan-2-yl]amino]piperidin-1-yl]methanone
CID 97232471
(4-chlorophenyl)-[4-(methylamino)piperidin-1-yl]methanone
CID 83728657
furan-2-yl-[4-(2-methoxyethyl)piperidin-1-yl]methanone
CID 53150870
[1-(4-chlorobenzoyl)piperidin-4-yl]azanium
CID 7183143
4-[4-(4-chlorophenoxy)piperidine-1-carbonyl]-N-(2-methoxyethyl)-N-methylbenzamide
CID 67169499
methyl 4-[4-(methoxymethyl)piperidine-1-carbonyl]benzoate
CID 121091427
(4-chlorophenyl)-[4-(4-methoxyphenoxy)piperidin-1-yl]methanone
CID 110396841
1-[4-(4-chlorobenzoyl)-1,4-diazepan-1-yl]-2-methoxyethanone
CID 108544814
(4-chlorophenyl)-[4-(2-methylpropylsulfonyl)piperidin-1-yl]methanone
CID 90589993

Frequently Asked Questions

What is the IUPAC name of (4-chlorophenyl)-[4-(2-methoxyethyl)piperidin-1-yl]methanone?
The IUPAC name of (4-chlorophenyl)-[4-(2-methoxyethyl)piperidin-1-yl]methanone (CID 53150807) is (4-chlorophenyl)-[4-(2-methoxyethyl)piperidin-1-yl]methanone.
What is the SMILES notation for (4-chlorophenyl)-[4-(2-methoxyethyl)piperidin-1-yl]methanone?
The canonical SMILES for (4-chlorophenyl)-[4-(2-methoxyethyl)piperidin-1-yl]methanone is COCCC1CCN(C(=O)c2ccc(Cl)cc2)CC1.
What is the InChIKey of (4-chlorophenyl)-[4-(2-methoxyethyl)piperidin-1-yl]methanone?
The InChIKey is QQAMVBRHXZVMPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20ClNO2/c1-19-11-8-12-6-9-17(10-7-12)15(18)13-2-4-14(16)5-3-13/h2-5,12H,6-11H2,1H3.
What are the key properties of (4-chlorophenyl)-[4-(2-methoxyethyl)piperidin-1-yl]methanone?
(4-chlorophenyl)-[4-(2-methoxyethyl)piperidin-1-yl]methanone has a molecular weight of 281.78 g/mol, XLogP of 3.23, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chlorophenyl)-[4-(2-methoxyethyl)piperidin-1-yl]methanone is sourced from PubChem (CID 53150807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).