[(2S)-2-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]-(1-phenylcyclopropyl)methanone

C19H23N3O — CID 124961992

IUPAC[(2S)-2-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]-(1-phenylcyclopropyl)methanone
SMILESCc1cn[nH]c1[C@@H]1CCCCN1C(=O)C1(c2ccccc2)CC1
InChIInChI=1S/C19H23N3O/c1-14-13-20-21-17(14)16-9-5-6-12-22(16)18(23)19(10-11-19)15-7-3-2-4-8-15/h2-4,7-8,13,16H,5-6,9-12H2,1H3,(H,20,21)/t16-/m0/s1
InChIKeyHFPCAKXFTSMHIW-INIZCTEOSA-N
MW309.41 g/mol
LogP3.50
Rot. Bonds3

About [(2S)-2-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]-(1-phenylcyclopropyl)methanone

[(2S)-2-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]-(1-phenylcyclopropyl)methanone (PubChem CID 124961992) has the molecular formula C19H23N3O and a molecular weight of 309.41 g/mol. Its IUPAC name is [(2S)-2-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]-(1-phenylcyclopropyl)methanone.

Molecular Properties

Compound Name[(2S)-2-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]-(1-phenylcyclopropyl)methanone
PubChem CID124961992
Molecular FormulaC19H23N3O
Molecular Weight309.41 g/mol
Exact Mass309.18
IUPAC Name[(2S)-2-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]-(1-phenylcyclopropyl)methanone
SMILESCc1cn[nH]c1[C@@H]1CCCCN1C(=O)C1(c2ccccc2)CC1
InChIInChI=1S/C19H23N3O/c1-14-13-20-21-17(14)16-9-5-6-12-22(16)18(23)19(10-11-19)15-7-3-2-4-8-15/h2-4,7-8,13,16H,5-6,9-12H2,1H3,(H,20,21)/t16-/m0/s1
InChIKeyHFPCAKXFTSMHIW-INIZCTEOSA-N
XLogP3.50
TPSA48.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [(2S)-2-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]-(1-phenylcyclopropyl)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

[(3S)-3-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]-(1-phenylcyclopropyl)methanone
CID 124997224
[2-(5-methyl-1H-imidazol-2-yl)pyrrolidin-1-yl]-(1-phenylcyclopropyl)methanone
CID 110104394
(1-phenylcyclopropyl)-[2-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl]methanone
CID 87052044
[2-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]-(1-methylpyrrol-2-yl)methanone
CID 127247295
3-(2-fluorophenyl)-1-[(2R)-2-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]propan-1-one
CID 124950069
3-(benzotriazol-1-yl)-1-[(2R)-2-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]propan-1-one
CID 124994474
[2-(methylaminomethyl)piperidin-1-yl]-(1-phenylcyclopropyl)methanone
CID 63249167
[2-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]-pyrazin-2-ylmethanone
CID 110270767
2-ethoxy-1-[2-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]ethanone
CID 73439591
1-[2-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]-3-morpholin-4-ylpropan-1-one
CID 110096331
1-[(2R)-2-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]-2-(5-methylthiophen-2-yl)ethanone
CID 124941970
(2-ethylpiperidin-1-yl)-(1-phenylcyclobutyl)methanone
CID 110487740

Frequently Asked Questions

What is the IUPAC name of [(2S)-2-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]-(1-phenylcyclopropyl)methanone?
The IUPAC name of [(2S)-2-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]-(1-phenylcyclopropyl)methanone (CID 124961992) is [(2S)-2-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]-(1-phenylcyclopropyl)methanone.
What is the SMILES notation for [(2S)-2-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]-(1-phenylcyclopropyl)methanone?
The canonical SMILES for [(2S)-2-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]-(1-phenylcyclopropyl)methanone is Cc1cn[nH]c1[C@@H]1CCCCN1C(=O)C1(c2ccccc2)CC1.
What is the InChIKey of [(2S)-2-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]-(1-phenylcyclopropyl)methanone?
The InChIKey is HFPCAKXFTSMHIW-INIZCTEOSA-N. The full InChI is InChI=1S/C19H23N3O/c1-14-13-20-21-17(14)16-9-5-6-12-22(16)18(23)19(10-11-19)15-7-3-2-4-8-15/h2-4,7-8,13,16H,5-6,9-12H2,1H3,(H,20,21)/t16-/m0/s1.
What are the key properties of [(2S)-2-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]-(1-phenylcyclopropyl)methanone?
[(2S)-2-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]-(1-phenylcyclopropyl)methanone has a molecular weight of 309.41 g/mol, XLogP of 3.50, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S)-2-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]-(1-phenylcyclopropyl)methanone is sourced from PubChem (CID 124961992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).