4-(3-aminocyclopentanecarbonyl)-1-(1-methylpyrazol-4-yl)piperazin-2-one

C14H21N5O2 — CID 119793437

IUPAC4-(3-aminocyclopentanecarbonyl)-1-(1-methylpyrazol-4-yl)piperazin-2-one
SMILESCn1cc(N2CCN(C(=O)C3CCC(N)C3)CC2=O)cn1
InChIInChI=1S/C14H21N5O2/c1-17-8-12(7-16-17)19-5-4-18(9-13(19)20)14(21)10-2-3-11(15)6-10/h7-8,10-11H,2-6,9,15H2,1H3
InChIKeyIMDCHZYVMPWROV-UHFFFAOYSA-N
MW291.35 g/mol
LogP-0.28
Rot. Bonds2

About 4-(3-aminocyclopentanecarbonyl)-1-(1-methylpyrazol-4-yl)piperazin-2-one

4-(3-aminocyclopentanecarbonyl)-1-(1-methylpyrazol-4-yl)piperazin-2-one (PubChem CID 119793437) has the molecular formula C14H21N5O2 and a molecular weight of 291.35 g/mol. Its IUPAC name is 4-(3-aminocyclopentanecarbonyl)-1-(1-methylpyrazol-4-yl)piperazin-2-one.

Molecular Properties

Compound Name4-(3-aminocyclopentanecarbonyl)-1-(1-methylpyrazol-4-yl)piperazin-2-one
PubChem CID119793437
Molecular FormulaC14H21N5O2
Molecular Weight291.35 g/mol
Exact Mass291.17
IUPAC Name4-(3-aminocyclopentanecarbonyl)-1-(1-methylpyrazol-4-yl)piperazin-2-one
SMILESCn1cc(N2CCN(C(=O)C3CCC(N)C3)CC2=O)cn1
InChIInChI=1S/C14H21N5O2/c1-17-8-12(7-16-17)19-5-4-18(9-13(19)20)14(21)10-2-3-11(15)6-10/h7-8,10-11H,2-6,9,15H2,1H3
InChIKeyIMDCHZYVMPWROV-UHFFFAOYSA-N
XLogP-0.28
TPSA84.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 5-0.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[(1R,3S)-3-aminocyclohexanecarbonyl]-1-(1-methylpyrazol-4-yl)piperazin-2-one
CID 124696393
4-[(2S,4S)-2-methylpiperidine-4-carbonyl]-1-(1-methylpyrazol-4-yl)piperazin-2-one;hydrochloride
CID 120634332
[(1S,3S)-3-aminocyclohexyl]-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]methanone
CID 124696422
4-(2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carbonyl)-1-(1-methylpyrazol-4-yl)piperazin-2-one
CID 119329129
4-(2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carbonyl)-1-(1-methylpyrazol-4-yl)piperazin-2-one;hydrochloride
CID 119329128
N-(4-methylcyclohexyl)-4-(1-methylpyrazol-4-yl)-3-oxopiperazine-1-carboxamide
CID 75408355
4-[(1S,3R)-3-aminocyclohexanecarbonyl]-1-methylpiperazin-2-one
CID 124509944
4-[(2S)-2-(dimethylamino)-3-methylbutanoyl]-1-(1-methylpyrazol-4-yl)piperazin-2-one
CID 154739436
N-[[(1R)-cyclohex-3-en-1-yl]methyl]-4-(1-methylpyrazol-4-yl)-3-oxopiperazine-1-carboxamide
CID 97075643
N-cyclohexyl-2-[[N-methyl-C-[4-(1-methylpyrazol-4-yl)-3-oxopiperazin-1-yl]carbonimidoyl]amino]acetamide
CID 109436435
(3-aminocyclopentyl)-[2-(1-methylpyrazol-4-yl)pyrrolidin-1-yl]methanone
CID 119877945
1-(1-methylpyrazol-4-yl)-4-(5-methyl-1,3,4-thiadiazole-2-carbonyl)piperazin-2-one
CID 127850919

Frequently Asked Questions

What is the IUPAC name of 4-(3-aminocyclopentanecarbonyl)-1-(1-methylpyrazol-4-yl)piperazin-2-one?
The IUPAC name of 4-(3-aminocyclopentanecarbonyl)-1-(1-methylpyrazol-4-yl)piperazin-2-one (CID 119793437) is 4-(3-aminocyclopentanecarbonyl)-1-(1-methylpyrazol-4-yl)piperazin-2-one.
What is the SMILES notation for 4-(3-aminocyclopentanecarbonyl)-1-(1-methylpyrazol-4-yl)piperazin-2-one?
The canonical SMILES for 4-(3-aminocyclopentanecarbonyl)-1-(1-methylpyrazol-4-yl)piperazin-2-one is Cn1cc(N2CCN(C(=O)C3CCC(N)C3)CC2=O)cn1.
What is the InChIKey of 4-(3-aminocyclopentanecarbonyl)-1-(1-methylpyrazol-4-yl)piperazin-2-one?
The InChIKey is IMDCHZYVMPWROV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O2/c1-17-8-12(7-16-17)19-5-4-18(9-13(19)20)14(21)10-2-3-11(15)6-10/h7-8,10-11H,2-6,9,15H2,1H3.
What are the key properties of 4-(3-aminocyclopentanecarbonyl)-1-(1-methylpyrazol-4-yl)piperazin-2-one?
4-(3-aminocyclopentanecarbonyl)-1-(1-methylpyrazol-4-yl)piperazin-2-one has a molecular weight of 291.35 g/mol, XLogP of -0.28, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-aminocyclopentanecarbonyl)-1-(1-methylpyrazol-4-yl)piperazin-2-one is sourced from PubChem (CID 119793437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).