2-[1-(2-chlorobenzoyl)piperidin-4-yl]-N-(2-morpholin-4-ylethyl)acetamide

C20H28ClN3O3 — CID 46295281

IUPAC2-[1-(2-chlorobenzoyl)piperidin-4-yl]-N-(2-morpholin-4-ylethyl)acetamide
SMILESO=C(CC1CCN(C(=O)c2ccccc2Cl)CC1)NCCN1CCOCC1
InChIInChI=1S/C20H28ClN3O3/c21-18-4-2-1-3-17(18)20(26)24-8-5-16(6-9-24)15-19(25)22-7-10-23-11-13-27-14-12-23/h1-4,16H,5-15H2,(H,22,25)
InChIKeyHZEAPYJDJDKUSE-UHFFFAOYSA-N
MW393.92 g/mol
LogP2.03
Rot. Bonds6

About 2-[1-(2-chlorobenzoyl)piperidin-4-yl]-N-(2-morpholin-4-ylethyl)acetamide

2-[1-(2-chlorobenzoyl)piperidin-4-yl]-N-(2-morpholin-4-ylethyl)acetamide (PubChem CID 46295281) has the molecular formula C20H28ClN3O3 and a molecular weight of 393.92 g/mol. Its IUPAC name is 2-[1-(2-chlorobenzoyl)piperidin-4-yl]-N-(2-morpholin-4-ylethyl)acetamide.

Molecular Properties

Compound Name2-[1-(2-chlorobenzoyl)piperidin-4-yl]-N-(2-morpholin-4-ylethyl)acetamide
PubChem CID46295281
Molecular FormulaC20H28ClN3O3
Molecular Weight393.92 g/mol
Exact Mass393.18
IUPAC Name2-[1-(2-chlorobenzoyl)piperidin-4-yl]-N-(2-morpholin-4-ylethyl)acetamide
SMILESO=C(CC1CCN(C(=O)c2ccccc2Cl)CC1)NCCN1CCOCC1
InChIInChI=1S/C20H28ClN3O3/c21-18-4-2-1-3-17(18)20(26)24-8-5-16(6-9-24)15-19(25)22-7-10-23-11-13-27-14-12-23/h1-4,16H,5-15H2,(H,22,25)
InChIKeyHZEAPYJDJDKUSE-UHFFFAOYSA-N
XLogP2.03
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.92
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[1-(2-chlorobenzoyl)piperidin-4-yl]-N-[3-(4-cyclohexylpiperazin-1-yl)propyl]acetamide
CID 46295293
2-chloro-N-(2-morpholin-4-ylethyl)benzamide
CID 799090
2-(2-chlorophenyl)-N-(2-morpholin-4-ylethyl)acetamide
CID 17217479
methyl 2-[1-(2-chlorobenzoyl)piperidin-4-yl]acetate
CID 142714825
N-(2-morpholin-4-ylethyl)-2-[1-(2-phenyl-1,3-benzoxazole-5-carbonyl)piperidin-4-yl]acetamide
CID 53103391
4-(2-chlorophenyl)-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]-4-oxobutanamide
CID 110625338
N-(4-fluorophenyl)-5-[4-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]piperidine-1-carbonyl]-1,3,4-thiadiazole-2-carboxamide
CID 46330796
2-[1-(4-methylbenzoyl)piperidin-4-yl]-N-(2-pyrrolidin-1-ylethyl)acetamide
CID 46295063
[2-[[1-(2-chlorobenzoyl)piperidin-4-yl]methoxy]phenyl]-morpholin-4-ylmethanone
CID 50846409
2-[1-(2-chlorobenzoyl)piperidin-4-yl]-1-piperidin-1-ylethanone
CID 46295282
ethyl 2,4-dimethyl-5-[4-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]piperidine-1-carbonyl]-1H-pyrrole-3-carboxylate
CID 50787533
3-(4-benzylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)propanamide
CID 109016578

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-chlorobenzoyl)piperidin-4-yl]-N-(2-morpholin-4-ylethyl)acetamide?
The IUPAC name of 2-[1-(2-chlorobenzoyl)piperidin-4-yl]-N-(2-morpholin-4-ylethyl)acetamide (CID 46295281) is 2-[1-(2-chlorobenzoyl)piperidin-4-yl]-N-(2-morpholin-4-ylethyl)acetamide.
What is the SMILES notation for 2-[1-(2-chlorobenzoyl)piperidin-4-yl]-N-(2-morpholin-4-ylethyl)acetamide?
The canonical SMILES for 2-[1-(2-chlorobenzoyl)piperidin-4-yl]-N-(2-morpholin-4-ylethyl)acetamide is O=C(CC1CCN(C(=O)c2ccccc2Cl)CC1)NCCN1CCOCC1.
What is the InChIKey of 2-[1-(2-chlorobenzoyl)piperidin-4-yl]-N-(2-morpholin-4-ylethyl)acetamide?
The InChIKey is HZEAPYJDJDKUSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28ClN3O3/c21-18-4-2-1-3-17(18)20(26)24-8-5-16(6-9-24)15-19(25)22-7-10-23-11-13-27-14-12-23/h1-4,16H,5-15H2,(H,22,25).
What are the key properties of 2-[1-(2-chlorobenzoyl)piperidin-4-yl]-N-(2-morpholin-4-ylethyl)acetamide?
2-[1-(2-chlorobenzoyl)piperidin-4-yl]-N-(2-morpholin-4-ylethyl)acetamide has a molecular weight of 393.92 g/mol, XLogP of 2.03, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-chlorobenzoyl)piperidin-4-yl]-N-(2-morpholin-4-ylethyl)acetamide is sourced from PubChem (CID 46295281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).