5-[4-(4-chlorophenyl)piperazine-1-carbonyl]-1-cyclopropylpiperidin-2-one

C19H24ClN3O2 — CID 24791970

IUPAC5-[4-(4-chlorophenyl)piperazine-1-carbonyl]-1-cyclopropylpiperidin-2-one
SMILESO=C(C1CCC(=O)N(C2CC2)C1)N1CCN(c2ccc(Cl)cc2)CC1
InChIInChI=1S/C19H24ClN3O2/c20-15-2-4-16(5-3-15)21-9-11-22(12-10-21)19(25)14-1-8-18(24)23(13-14)17-6-7-17/h2-5,14,17H,1,6-13H2
InChIKeyKBRXRGVGWBVXKI-UHFFFAOYSA-N
MW361.87 g/mol
LogP2.39
Rot. Bonds3

About 5-[4-(4-chlorophenyl)piperazine-1-carbonyl]-1-cyclopropylpiperidin-2-one

5-[4-(4-chlorophenyl)piperazine-1-carbonyl]-1-cyclopropylpiperidin-2-one (PubChem CID 24791970) has the molecular formula C19H24ClN3O2 and a molecular weight of 361.87 g/mol. Its IUPAC name is 5-[4-(4-chlorophenyl)piperazine-1-carbonyl]-1-cyclopropylpiperidin-2-one.

Molecular Properties

Compound Name5-[4-(4-chlorophenyl)piperazine-1-carbonyl]-1-cyclopropylpiperidin-2-one
PubChem CID24791970
Molecular FormulaC19H24ClN3O2
Molecular Weight361.87 g/mol
Exact Mass361.16
IUPAC Name5-[4-(4-chlorophenyl)piperazine-1-carbonyl]-1-cyclopropylpiperidin-2-one
SMILESO=C(C1CCC(=O)N(C2CC2)C1)N1CCN(c2ccc(Cl)cc2)CC1
InChIInChI=1S/C19H24ClN3O2/c20-15-2-4-16(5-3-15)21-9-11-22(12-10-21)19(25)14-1-8-18(24)23(13-14)17-6-7-17/h2-5,14,17H,1,6-13H2
InChIKeyKBRXRGVGWBVXKI-UHFFFAOYSA-N
XLogP2.39
TPSA43.86 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.87
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(5R)-1-cyclopropyl-5-[4-(3-methyl-2-pyridinyl)piperazine-1-carbonyl]piperidin-2-one
CID 42189910
1-cyclohexyl-4-(4-phenylpiperazine-1-carbonyl)pyrrolidin-2-one
CID 2986614
1-(4-chlorophenyl)-4-[4-(4-fluorophenyl)piperazine-1-carbonyl]pyrrolidin-2-one
CID 17082146
1-[4-[4-(4-chlorophenyl)piperazine-1-carbonyl]piperidin-1-yl]-2,2-dimethylpropan-1-one
CID 55969919
(4S)-4-[4-(3-chloro-2-pyridinyl)piperazine-1-carbonyl]-1-cyclopropylpyrrolidin-2-one
CID 94178191
(5R)-1-cyclopentyl-5-[4-(1H-1,2,4-triazol-5-yl)piperazine-1-carbonyl]piperidin-2-one
CID 126451283
1-cyclopentyl-5-[4-(3,6-dimethylpyrazin-2-yl)piperazine-1-carbonyl]piperidin-2-one
CID 45213447
1-cycloheptyl-4-[4-(4-methoxyphenyl)piperazine-1-carbonyl]pyrrolidin-2-one
CID 113185530
[4-(4-chlorophenyl)piperazin-1-yl]-[(3R)-piperidin-3-yl]methanone
CID 81118918
(4R)-4-[4-(2-chlorophenyl)piperazine-1-carbonyl]-1-cyclopentylpyrrolidin-2-one
CID 27536013
(4S)-1-cyclohexyl-4-[4-(4-nitrophenyl)piperazine-1-carbonyl]pyrrolidin-2-one
CID 7345959
4-(4-chlorophenyl)-N'-[(1-cyclopropyl-5-oxopyrrolidin-3-yl)methyl]piperazine-1-carboximidamide;hydroiodide
CID 110018465

Frequently Asked Questions

What is the IUPAC name of 5-[4-(4-chlorophenyl)piperazine-1-carbonyl]-1-cyclopropylpiperidin-2-one?
The IUPAC name of 5-[4-(4-chlorophenyl)piperazine-1-carbonyl]-1-cyclopropylpiperidin-2-one (CID 24791970) is 5-[4-(4-chlorophenyl)piperazine-1-carbonyl]-1-cyclopropylpiperidin-2-one.
What is the SMILES notation for 5-[4-(4-chlorophenyl)piperazine-1-carbonyl]-1-cyclopropylpiperidin-2-one?
The canonical SMILES for 5-[4-(4-chlorophenyl)piperazine-1-carbonyl]-1-cyclopropylpiperidin-2-one is O=C(C1CCC(=O)N(C2CC2)C1)N1CCN(c2ccc(Cl)cc2)CC1.
What is the InChIKey of 5-[4-(4-chlorophenyl)piperazine-1-carbonyl]-1-cyclopropylpiperidin-2-one?
The InChIKey is KBRXRGVGWBVXKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24ClN3O2/c20-15-2-4-16(5-3-15)21-9-11-22(12-10-21)19(25)14-1-8-18(24)23(13-14)17-6-7-17/h2-5,14,17H,1,6-13H2.
What are the key properties of 5-[4-(4-chlorophenyl)piperazine-1-carbonyl]-1-cyclopropylpiperidin-2-one?
5-[4-(4-chlorophenyl)piperazine-1-carbonyl]-1-cyclopropylpiperidin-2-one has a molecular weight of 361.87 g/mol, XLogP of 2.39, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-(4-chlorophenyl)piperazine-1-carbonyl]-1-cyclopropylpiperidin-2-one is sourced from PubChem (CID 24791970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).