[4-(4-methylpyrazol-1-yl)piperidin-1-yl]-(2-phenyl-1,3-oxazol-5-yl)methanone

C19H20N4O2 — CID 166253150

IUPAC[4-(4-methylpyrazol-1-yl)piperidin-1-yl]-(2-phenyl-1,3-oxazol-5-yl)methanone
SMILESCc1cnn(C2CCN(C(=O)c3cnc(-c4ccccc4)o3)CC2)c1
InChIInChI=1S/C19H20N4O2/c1-14-11-21-23(13-14)16-7-9-22(10-8-16)19(24)17-12-20-18(25-17)15-5-3-2-4-6-15/h2-6,11-13,16H,7-10H2,1H3
InChIKeyHROVUPQBQYZSBC-UHFFFAOYSA-N
MW336.40 g/mol
LogP3.32
Rot. Bonds3

About [4-(4-methylpyrazol-1-yl)piperidin-1-yl]-(2-phenyl-1,3-oxazol-5-yl)methanone

[4-(4-methylpyrazol-1-yl)piperidin-1-yl]-(2-phenyl-1,3-oxazol-5-yl)methanone (PubChem CID 166253150) has the molecular formula C19H20N4O2 and a molecular weight of 336.40 g/mol. Its IUPAC name is [4-(4-methylpyrazol-1-yl)piperidin-1-yl]-(2-phenyl-1,3-oxazol-5-yl)methanone.

Molecular Properties

Compound Name[4-(4-methylpyrazol-1-yl)piperidin-1-yl]-(2-phenyl-1,3-oxazol-5-yl)methanone
PubChem CID166253150
Molecular FormulaC19H20N4O2
Molecular Weight336.40 g/mol
Exact Mass336.16
IUPAC Name[4-(4-methylpyrazol-1-yl)piperidin-1-yl]-(2-phenyl-1,3-oxazol-5-yl)methanone
SMILESCc1cnn(C2CCN(C(=O)c3cnc(-c4ccccc4)o3)CC2)c1
InChIInChI=1S/C19H20N4O2/c1-14-11-21-23(13-14)16-7-9-22(10-8-16)19(24)17-12-20-18(25-17)15-5-3-2-4-6-15/h2-6,11-13,16H,7-10H2,1H3
InChIKeyHROVUPQBQYZSBC-UHFFFAOYSA-N
XLogP3.32
TPSA64.16 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

(2-phenyl-1,3-oxazol-5-yl)-pyrrolidin-1-ylmethanone
CID 110681388
[3-(4-methylpyrazol-1-yl)pyrrolidin-1-yl]-(1,2-oxazol-5-yl)methanone
CID 126947144
[(3R,4R)-4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-hydroxypiperidin-1-yl]-(2-phenyl-1,3-oxazol-5-yl)methanone
CID 176799617
[(3S)-3-(4-methylpyrazol-1-yl)piperidin-1-yl]-(5-phenyl-1H-pyrazol-4-yl)methanone
CID 95282732
[2-(4-ethoxyphenyl)-1,3-thiazol-4-yl]-[4-(4-methylpyrazol-1-yl)piperidin-1-yl]methanone
CID 75463650
(2-methyl-1,3-oxazol-4-yl)-[3-(4-methylpyrazol-1-yl)pyrrolidin-1-yl]methanone
CID 126947235
3-[3-(4-methylpyrazol-1-yl)pyrrolidine-1-carbonyl]benzamide
CID 136543844
1,3-benzothiazol-6-yl-[3-(4-methylpyrazol-1-yl)pyrrolidin-1-yl]methanone
CID 126947149
N-(2,3-difluoro-4-pyridinyl)-4-(4-methylpyrazol-1-yl)piperidine-1-carboxamide
CID 167909053
[4-[4-(2-methylpropyl)pyrazol-1-yl]piperidin-1-yl]-pyridin-2-ylmethanone
CID 164836489
1-[3-[3-(4-methylpyrazol-1-yl)pyrrolidine-1-carbonyl]azetidin-1-yl]ethanone
CID 136543837
(5-cyclopropyl-1,2-oxazol-3-yl)-[3-(4-methylpyrazol-1-yl)pyrrolidin-1-yl]methanone
CID 126947170

Frequently Asked Questions

What is the IUPAC name of [4-(4-methylpyrazol-1-yl)piperidin-1-yl]-(2-phenyl-1,3-oxazol-5-yl)methanone?
The IUPAC name of [4-(4-methylpyrazol-1-yl)piperidin-1-yl]-(2-phenyl-1,3-oxazol-5-yl)methanone (CID 166253150) is [4-(4-methylpyrazol-1-yl)piperidin-1-yl]-(2-phenyl-1,3-oxazol-5-yl)methanone.
What is the SMILES notation for [4-(4-methylpyrazol-1-yl)piperidin-1-yl]-(2-phenyl-1,3-oxazol-5-yl)methanone?
The canonical SMILES for [4-(4-methylpyrazol-1-yl)piperidin-1-yl]-(2-phenyl-1,3-oxazol-5-yl)methanone is Cc1cnn(C2CCN(C(=O)c3cnc(-c4ccccc4)o3)CC2)c1.
What is the InChIKey of [4-(4-methylpyrazol-1-yl)piperidin-1-yl]-(2-phenyl-1,3-oxazol-5-yl)methanone?
The InChIKey is HROVUPQBQYZSBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O2/c1-14-11-21-23(13-14)16-7-9-22(10-8-16)19(24)17-12-20-18(25-17)15-5-3-2-4-6-15/h2-6,11-13,16H,7-10H2,1H3.
What are the key properties of [4-(4-methylpyrazol-1-yl)piperidin-1-yl]-(2-phenyl-1,3-oxazol-5-yl)methanone?
[4-(4-methylpyrazol-1-yl)piperidin-1-yl]-(2-phenyl-1,3-oxazol-5-yl)methanone has a molecular weight of 336.40 g/mol, XLogP of 3.32, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-methylpyrazol-1-yl)piperidin-1-yl]-(2-phenyl-1,3-oxazol-5-yl)methanone is sourced from PubChem (CID 166253150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).