(1-methyl-3-piperidin-3-ylpyrazol-4-yl)-[4-(oxolan-2-yl)piperidin-1-yl]methanone

C19H30N4O2 — CID 128882752

IUPAC(1-methyl-3-piperidin-3-ylpyrazol-4-yl)-[4-(oxolan-2-yl)piperidin-1-yl]methanone
SMILESCn1cc(C(=O)N2CCC(C3CCCO3)CC2)c(C2CCCNC2)n1
InChIInChI=1S/C19H30N4O2/c1-22-13-16(18(21-22)15-4-2-8-20-12-15)19(24)23-9-6-14(7-10-23)17-5-3-11-25-17/h13-15,17,20H,2-12H2,1H3
InChIKeyXWTSAHRGIMWKQU-UHFFFAOYSA-N
MW346.48 g/mol
LogP1.92
Rot. Bonds3

About (1-methyl-3-piperidin-3-ylpyrazol-4-yl)-[4-(oxolan-2-yl)piperidin-1-yl]methanone

(1-methyl-3-piperidin-3-ylpyrazol-4-yl)-[4-(oxolan-2-yl)piperidin-1-yl]methanone (PubChem CID 128882752) has the molecular formula C19H30N4O2 and a molecular weight of 346.48 g/mol. Its IUPAC name is (1-methyl-3-piperidin-3-ylpyrazol-4-yl)-[4-(oxolan-2-yl)piperidin-1-yl]methanone.

Molecular Properties

Compound Name(1-methyl-3-piperidin-3-ylpyrazol-4-yl)-[4-(oxolan-2-yl)piperidin-1-yl]methanone
PubChem CID128882752
Molecular FormulaC19H30N4O2
Molecular Weight346.48 g/mol
Exact Mass346.24
IUPAC Name(1-methyl-3-piperidin-3-ylpyrazol-4-yl)-[4-(oxolan-2-yl)piperidin-1-yl]methanone
SMILESCn1cc(C(=O)N2CCC(C3CCCO3)CC2)c(C2CCCNC2)n1
InChIInChI=1S/C19H30N4O2/c1-22-13-16(18(21-22)15-4-2-8-20-12-15)19(24)23-9-6-14(7-10-23)17-5-3-11-25-17/h13-15,17,20H,2-12H2,1H3
InChIKeyXWTSAHRGIMWKQU-UHFFFAOYSA-N
XLogP1.92
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.48
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (1-methyl-3-piperidin-3-ylpyrazol-4-yl)-[4-(oxolan-2-yl)piperidin-1-yl]methanone 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

(3-cyclohexyl-1-methylpyrazol-4-yl)-[4-[(2R)-2-hydroxypropyl]piperazin-1-yl]methanone
CID 95348396
(6-cyclopropyl-3-piperidin-3-yl-[1,2]oxazolo[5,4-b]pyridin-4-yl)-morpholin-4-ylmethanone
CID 134787837
morpholin-4-yl-[5-[(3R)-piperidin-3-yl]-1H-pyrazol-4-yl]methanone
CID 98041423
N-[6-(methoxymethyl)pyrimidin-4-yl]-4-[(2S)-oxolan-2-yl]piperidine-1-carboxamide
CID 124622149
[1-methyl-3-(oxolan-3-yl)pyrazol-4-yl]-[4-(4-methylphenoxy)piperidin-1-yl]methanone
CID 136533760
3-methyl-5-(1-methyl-3-piperidin-3-ylpyrazol-4-yl)-1,2,4-oxadiazole
CID 128881282
[4-(oxan-4-yl)piperazin-1-yl]-[4-[(3S)-piperidin-3-yl]phenyl]methanone
CID 97189193
(3-cyclopentyl-1-methylpyrazol-4-yl)-(6,7-dihydro-5H-tetrazolo[1,5-a]pyrimidin-4-yl)methanone
CID 154786700
N-[5-(3-methylbutyl)-2-pyridinyl]-4-(oxan-2-yl)piperidine-1-carboxamide
CID 136553393
(3-cyclohexyl-1-methylpyrazol-4-yl)-[(2R)-2-[(2R)-1-methylpyrrolidin-2-yl]pyrrolidin-1-yl]methanone
CID 95292675
[4-[(3-cyclopentyl-1-methylpyrazol-4-yl)methyl]piperazin-1-yl]-(oxolan-2-yl)methanone
CID 136568086
ethyl 3-cyclohexyl-1-methylpyrazole-4-carboxylate
CID 146167576

Frequently Asked Questions

What is the IUPAC name of (1-methyl-3-piperidin-3-ylpyrazol-4-yl)-[4-(oxolan-2-yl)piperidin-1-yl]methanone?
The IUPAC name of (1-methyl-3-piperidin-3-ylpyrazol-4-yl)-[4-(oxolan-2-yl)piperidin-1-yl]methanone (CID 128882752) is (1-methyl-3-piperidin-3-ylpyrazol-4-yl)-[4-(oxolan-2-yl)piperidin-1-yl]methanone.
What is the SMILES notation for (1-methyl-3-piperidin-3-ylpyrazol-4-yl)-[4-(oxolan-2-yl)piperidin-1-yl]methanone?
The canonical SMILES for (1-methyl-3-piperidin-3-ylpyrazol-4-yl)-[4-(oxolan-2-yl)piperidin-1-yl]methanone is Cn1cc(C(=O)N2CCC(C3CCCO3)CC2)c(C2CCCNC2)n1.
What is the InChIKey of (1-methyl-3-piperidin-3-ylpyrazol-4-yl)-[4-(oxolan-2-yl)piperidin-1-yl]methanone?
The InChIKey is XWTSAHRGIMWKQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N4O2/c1-22-13-16(18(21-22)15-4-2-8-20-12-15)19(24)23-9-6-14(7-10-23)17-5-3-11-25-17/h13-15,17,20H,2-12H2,1H3.
What are the key properties of (1-methyl-3-piperidin-3-ylpyrazol-4-yl)-[4-(oxolan-2-yl)piperidin-1-yl]methanone?
(1-methyl-3-piperidin-3-ylpyrazol-4-yl)-[4-(oxolan-2-yl)piperidin-1-yl]methanone has a molecular weight of 346.48 g/mol, XLogP of 1.92, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methyl-3-piperidin-3-ylpyrazol-4-yl)-[4-(oxolan-2-yl)piperidin-1-yl]methanone is sourced from PubChem (CID 128882752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).