(3-chlorophenyl)-(4-morpholin-4-yl-4-phenylpiperidin-1-yl)methanone

C22H25ClN2O2 — CID 110409260

IUPAC(3-chlorophenyl)-(4-morpholin-4-yl-4-phenylpiperidin-1-yl)methanone
SMILESO=C(c1cccc(Cl)c1)N1CCC(c2ccccc2)(N2CCOCC2)CC1
InChIInChI=1S/C22H25ClN2O2/c23-20-8-4-5-18(17-20)21(26)24-11-9-22(10-12-24,19-6-2-1-3-7-19)25-13-15-27-16-14-25/h1-8,17H,9-16H2
InChIKeyFUXJVYOVZRCMJR-UHFFFAOYSA-N
MW384.91 g/mol
LogP3.80
Rot. Bonds3

About (3-chlorophenyl)-(4-morpholin-4-yl-4-phenylpiperidin-1-yl)methanone

(3-chlorophenyl)-(4-morpholin-4-yl-4-phenylpiperidin-1-yl)methanone (PubChem CID 110409260) has the molecular formula C22H25ClN2O2 and a molecular weight of 384.91 g/mol. Its IUPAC name is (3-chlorophenyl)-(4-morpholin-4-yl-4-phenylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name(3-chlorophenyl)-(4-morpholin-4-yl-4-phenylpiperidin-1-yl)methanone
PubChem CID110409260
Molecular FormulaC22H25ClN2O2
Molecular Weight384.91 g/mol
Exact Mass384.16
IUPAC Name(3-chlorophenyl)-(4-morpholin-4-yl-4-phenylpiperidin-1-yl)methanone
SMILESO=C(c1cccc(Cl)c1)N1CCC(c2ccccc2)(N2CCOCC2)CC1
InChIInChI=1S/C22H25ClN2O2/c23-20-8-4-5-18(17-20)21(26)24-11-9-22(10-12-24,19-6-2-1-3-7-19)25-13-15-27-16-14-25/h1-8,17H,9-16H2
InChIKeyFUXJVYOVZRCMJR-UHFFFAOYSA-N
XLogP3.80
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.91
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3-chlorophenyl)-(4-morpholin-4-yl-4-phenylpiperidin-1-yl)methanone?
The IUPAC name of (3-chlorophenyl)-(4-morpholin-4-yl-4-phenylpiperidin-1-yl)methanone (CID 110409260) is (3-chlorophenyl)-(4-morpholin-4-yl-4-phenylpiperidin-1-yl)methanone.
What is the SMILES notation for (3-chlorophenyl)-(4-morpholin-4-yl-4-phenylpiperidin-1-yl)methanone?
The canonical SMILES for (3-chlorophenyl)-(4-morpholin-4-yl-4-phenylpiperidin-1-yl)methanone is O=C(c1cccc(Cl)c1)N1CCC(c2ccccc2)(N2CCOCC2)CC1.
What is the InChIKey of (3-chlorophenyl)-(4-morpholin-4-yl-4-phenylpiperidin-1-yl)methanone?
The InChIKey is FUXJVYOVZRCMJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25ClN2O2/c23-20-8-4-5-18(17-20)21(26)24-11-9-22(10-12-24,19-6-2-1-3-7-19)25-13-15-27-16-14-25/h1-8,17H,9-16H2.
What are the key properties of (3-chlorophenyl)-(4-morpholin-4-yl-4-phenylpiperidin-1-yl)methanone?
(3-chlorophenyl)-(4-morpholin-4-yl-4-phenylpiperidin-1-yl)methanone has a molecular weight of 384.91 g/mol, XLogP of 3.80, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-chlorophenyl)-(4-morpholin-4-yl-4-phenylpiperidin-1-yl)methanone is sourced from PubChem (CID 110409260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).