4-(4-amino-5-propan-2-yl-1H-pyrazole-3-carbonyl)-1-methylpiperazin-2-one

C12H19N5O2 — CID 64682975

IUPAC4-(4-amino-5-propan-2-yl-1H-pyrazole-3-carbonyl)-1-methylpiperazin-2-one
SMILESCC(C)c1[nH]nc(C(=O)N2CCN(C)C(=O)C2)c1N
InChIInChI=1S/C12H19N5O2/c1-7(2)10-9(13)11(15-14-10)12(19)17-5-4-16(3)8(18)6-17/h7H,4-6,13H2,1-3H3,(H,14,15)
InChIKeyBTXUVZXOIOZFAU-UHFFFAOYSA-N
MW265.32 g/mol
LogP0.03
Rot. Bonds2

About 4-(4-amino-5-propan-2-yl-1H-pyrazole-3-carbonyl)-1-methylpiperazin-2-one

4-(4-amino-5-propan-2-yl-1H-pyrazole-3-carbonyl)-1-methylpiperazin-2-one (PubChem CID 64682975) has the molecular formula C12H19N5O2 and a molecular weight of 265.32 g/mol. Its IUPAC name is 4-(4-amino-5-propan-2-yl-1H-pyrazole-3-carbonyl)-1-methylpiperazin-2-one.

Molecular Properties

Compound Name4-(4-amino-5-propan-2-yl-1H-pyrazole-3-carbonyl)-1-methylpiperazin-2-one
PubChem CID64682975
Molecular FormulaC12H19N5O2
Molecular Weight265.32 g/mol
Exact Mass265.15
IUPAC Name4-(4-amino-5-propan-2-yl-1H-pyrazole-3-carbonyl)-1-methylpiperazin-2-one
SMILESCC(C)c1[nH]nc(C(=O)N2CCN(C)C(=O)C2)c1N
InChIInChI=1S/C12H19N5O2/c1-7(2)10-9(13)11(15-14-10)12(19)17-5-4-16(3)8(18)6-17/h7H,4-6,13H2,1-3H3,(H,14,15)
InChIKeyBTXUVZXOIOZFAU-UHFFFAOYSA-N
XLogP0.03
TPSA95.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 50.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-(4-amino-5-propan-2-yl-1H-pyrazole-3-carbonyl)-1-methylpiperazin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(4-amino-5-propan-2-yl-1H-pyrazol-3-yl)-[4-(cyclopropylmethyl)piperazin-1-yl]methanone
CID 62075582
(4-amino-5-propan-2-yl-1H-pyrazol-3-yl)-(3-ethyl-4-methylpiperazin-1-yl)methanone
CID 63603103
(4-amino-5-propan-2-yl-1H-pyrazol-3-yl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone
CID 107209805
(4-amino-5-propan-2-yl-1H-pyrazol-3-yl)-(3-methylpiperidin-1-yl)methanone
CID 62076034
(4-amino-5-propan-2-yl-1H-pyrazol-3-yl)-(2,6-dimethylmorpholin-4-yl)methanone
CID 62075873
(4-amino-5-propan-2-yl-1H-pyrazol-3-yl)-[3-(1-hydroxyethyl)pyrrolidin-1-yl]methanone
CID 112623797
(4-amino-5-propan-2-yl-1H-pyrazol-3-yl)-(3-ethyl-3-hydroxyazetidin-1-yl)methanone
CID 107210661
(4-amino-5-propan-2-yl-1H-pyrazol-3-yl)-[4-(2-hydroxyethoxy)piperidin-1-yl]methanone
CID 82012290
4-(4-amino-5-propan-2-yl-1H-pyrazole-3-carbonyl)-3-methylpiperazine-2,6-dione
CID 66062261
4-(4-amino-5-propan-2-yl-1H-pyrazole-3-carbonyl)-3-methylpiperazin-2-one
CID 63596627
(4-amino-5-propan-2-yl-1H-pyrazol-3-yl)-(3-ethoxypiperidin-1-yl)methanone
CID 62076805
4-(1H-indazole-3-carbonyl)-1-methyl-1,4-diazepan-2-one
CID 102847847

Frequently Asked Questions

What is the IUPAC name of 4-(4-amino-5-propan-2-yl-1H-pyrazole-3-carbonyl)-1-methylpiperazin-2-one?
The IUPAC name of 4-(4-amino-5-propan-2-yl-1H-pyrazole-3-carbonyl)-1-methylpiperazin-2-one (CID 64682975) is 4-(4-amino-5-propan-2-yl-1H-pyrazole-3-carbonyl)-1-methylpiperazin-2-one.
What is the SMILES notation for 4-(4-amino-5-propan-2-yl-1H-pyrazole-3-carbonyl)-1-methylpiperazin-2-one?
The canonical SMILES for 4-(4-amino-5-propan-2-yl-1H-pyrazole-3-carbonyl)-1-methylpiperazin-2-one is CC(C)c1[nH]nc(C(=O)N2CCN(C)C(=O)C2)c1N.
What is the InChIKey of 4-(4-amino-5-propan-2-yl-1H-pyrazole-3-carbonyl)-1-methylpiperazin-2-one?
The InChIKey is BTXUVZXOIOZFAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5O2/c1-7(2)10-9(13)11(15-14-10)12(19)17-5-4-16(3)8(18)6-17/h7H,4-6,13H2,1-3H3,(H,14,15).
What are the key properties of 4-(4-amino-5-propan-2-yl-1H-pyrazole-3-carbonyl)-1-methylpiperazin-2-one?
4-(4-amino-5-propan-2-yl-1H-pyrazole-3-carbonyl)-1-methylpiperazin-2-one has a molecular weight of 265.32 g/mol, XLogP of 0.03, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-amino-5-propan-2-yl-1H-pyrazole-3-carbonyl)-1-methylpiperazin-2-one is sourced from PubChem (CID 64682975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).