(5-methyl-2-phenylpyrazol-3-yl)-morpholin-4-ylmethanone

C15H17N3O2 — CID 5307617

IUPAC(5-methyl-2-phenylpyrazol-3-yl)-morpholin-4-ylmethanone
SMILESCc1cc(C(=O)N2CCOCC2)n(-c2ccccc2)n1
InChIInChI=1S/C15H17N3O2/c1-12-11-14(15(19)17-7-9-20-10-8-17)18(16-12)13-5-3-2-4-6-13/h2-6,11H,7-10H2,1H3
InChIKeyAKMXMSBPHKHDNV-UHFFFAOYSA-N
MW271.32 g/mol
LogP1.65
Rot. Bonds2

About (5-methyl-2-phenylpyrazol-3-yl)-morpholin-4-ylmethanone

(5-methyl-2-phenylpyrazol-3-yl)-morpholin-4-ylmethanone (PubChem CID 5307617) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is (5-methyl-2-phenylpyrazol-3-yl)-morpholin-4-ylmethanone.

Molecular Properties

Compound Name(5-methyl-2-phenylpyrazol-3-yl)-morpholin-4-ylmethanone
PubChem CID5307617
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC Name(5-methyl-2-phenylpyrazol-3-yl)-morpholin-4-ylmethanone
SMILESCc1cc(C(=O)N2CCOCC2)n(-c2ccccc2)n1
InChIInChI=1S/C15H17N3O2/c1-12-11-14(15(19)17-7-9-20-10-8-17)18(16-12)13-5-3-2-4-6-13/h2-6,11H,7-10H2,1H3
InChIKeyAKMXMSBPHKHDNV-UHFFFAOYSA-N
XLogP1.65
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

[3-Tert-butyl-1-[(3-methylphenyl)methyl]pyrazol-5-yl]-morpholin-4-ylmethanone
CID 2747308
4-(2-Fluorophenyl)piperazinyl 1-methylpyrazol-5-yl ketone
CID 6467697
1-[(1,3-dimethyl-1H-pyrazol-5-yl)carbonyl]-N-(4-fluorophenyl)-3-piperidinamine
CID 24790221
N-(2,2-dimethoxyethyl)-3-methyl-1-phenyl-1H-pyrazole-5-carboxamide
CID 3600852
(3,5-Dimethylpiperidin-1-yl)-(5-methyl-2-phenylpyrazol-3-yl)methanone
CID 5307799
3,4-Dimethyl-6-(2-oxo-2-pyrrolidin-1-ylethyl)-2-phenylpyrazolo[3,4-d]pyridazin-7-one
CID 20919651
3,4-Dimethyl-6-(1-oxo-1-pyrrolidin-1-ylbutan-2-yl)-2-phenylpyrazolo[3,4-d]pyridazin-7-one
CID 20919763
3-[2-[(N-ethyl-4-fluoroanilino)methyl]-7-methyl-4-oxopyrazolo[1,5-a]pyrazin-5-yl]propanenitrile
CID 168289223
[4-(4-Fluorophenyl)-1-piperazinyl]-(2-methyl-3-pyrazolyl)methanone
CID 1220811
(2,6-Dimethylmorpholin-4-yl)-[4-(3,5-dimethylpyrazol-1-yl)phenyl]methanone
CID 4567474
N-(3-methoxypropyl)-3-methyl-1-phenyl-1H-pyrazole-5-carboxamide
CID 16193354
N-butyl-3-methyl-1-phenyl-1H-pyrazole-5-carboxamide
CID 16193355

Frequently Asked Questions

What is the IUPAC name of (5-methyl-2-phenylpyrazol-3-yl)-morpholin-4-ylmethanone?
The IUPAC name of (5-methyl-2-phenylpyrazol-3-yl)-morpholin-4-ylmethanone (CID 5307617) is (5-methyl-2-phenylpyrazol-3-yl)-morpholin-4-ylmethanone.
What is the SMILES notation for (5-methyl-2-phenylpyrazol-3-yl)-morpholin-4-ylmethanone?
The canonical SMILES for (5-methyl-2-phenylpyrazol-3-yl)-morpholin-4-ylmethanone is Cc1cc(C(=O)N2CCOCC2)n(-c2ccccc2)n1.
What is the InChIKey of (5-methyl-2-phenylpyrazol-3-yl)-morpholin-4-ylmethanone?
The InChIKey is AKMXMSBPHKHDNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2/c1-12-11-14(15(19)17-7-9-20-10-8-17)18(16-12)13-5-3-2-4-6-13/h2-6,11H,7-10H2,1H3.
What are the key properties of (5-methyl-2-phenylpyrazol-3-yl)-morpholin-4-ylmethanone?
(5-methyl-2-phenylpyrazol-3-yl)-morpholin-4-ylmethanone has a molecular weight of 271.32 g/mol, XLogP of 1.65, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methyl-2-phenylpyrazol-3-yl)-morpholin-4-ylmethanone is sourced from PubChem (CID 5307617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).