2-(3,5-dimethyl-1H-pyrazol-4-yl)-1-[3-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]ethanone

C15H21N5O2 — CID 110105409

IUPAC2-(3,5-dimethyl-1H-pyrazol-4-yl)-1-[3-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]ethanone
SMILESCc1cnc(C2COCCN2C(=O)Cc2c(C)n[nH]c2C)[nH]1
InChIInChI=1S/C15H21N5O2/c1-9-7-16-15(17-9)13-8-22-5-4-20(13)14(21)6-12-10(2)18-19-11(12)3/h7,13H,4-6,8H2,1-3H3,(H,16,17)(H,18,19)
InChIKeyLVDMNMKMLWQKNY-UHFFFAOYSA-N
MW303.37 g/mol
LogP1.20
Rot. Bonds3

About 2-(3,5-dimethyl-1H-pyrazol-4-yl)-1-[3-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]ethanone

2-(3,5-dimethyl-1H-pyrazol-4-yl)-1-[3-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]ethanone (PubChem CID 110105409) has the molecular formula C15H21N5O2 and a molecular weight of 303.37 g/mol. Its IUPAC name is 2-(3,5-dimethyl-1H-pyrazol-4-yl)-1-[3-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]ethanone.

Molecular Properties

Compound Name2-(3,5-dimethyl-1H-pyrazol-4-yl)-1-[3-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]ethanone
PubChem CID110105409
Molecular FormulaC15H21N5O2
Molecular Weight303.37 g/mol
Exact Mass303.17
IUPAC Name2-(3,5-dimethyl-1H-pyrazol-4-yl)-1-[3-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]ethanone
SMILESCc1cnc(C2COCCN2C(=O)Cc2c(C)n[nH]c2C)[nH]1
InChIInChI=1S/C15H21N5O2/c1-9-7-16-15(17-9)13-8-22-5-4-20(13)14(21)6-12-10(2)18-19-11(12)3/h7,13H,4-6,8H2,1-3H3,(H,16,17)(H,18,19)
InChIKeyLVDMNMKMLWQKNY-UHFFFAOYSA-N
XLogP1.20
TPSA86.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.37
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethyl-1H-pyrazol-4-yl)-1-[3-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]ethanone?
The IUPAC name of 2-(3,5-dimethyl-1H-pyrazol-4-yl)-1-[3-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]ethanone (CID 110105409) is 2-(3,5-dimethyl-1H-pyrazol-4-yl)-1-[3-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]ethanone.
What is the SMILES notation for 2-(3,5-dimethyl-1H-pyrazol-4-yl)-1-[3-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]ethanone?
The canonical SMILES for 2-(3,5-dimethyl-1H-pyrazol-4-yl)-1-[3-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]ethanone is Cc1cnc(C2COCCN2C(=O)Cc2c(C)n[nH]c2C)[nH]1.
What is the InChIKey of 2-(3,5-dimethyl-1H-pyrazol-4-yl)-1-[3-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]ethanone?
The InChIKey is LVDMNMKMLWQKNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O2/c1-9-7-16-15(17-9)13-8-22-5-4-20(13)14(21)6-12-10(2)18-19-11(12)3/h7,13H,4-6,8H2,1-3H3,(H,16,17)(H,18,19).
What are the key properties of 2-(3,5-dimethyl-1H-pyrazol-4-yl)-1-[3-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]ethanone?
2-(3,5-dimethyl-1H-pyrazol-4-yl)-1-[3-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]ethanone has a molecular weight of 303.37 g/mol, XLogP of 1.20, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethyl-1H-pyrazol-4-yl)-1-[3-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]ethanone is sourced from PubChem (CID 110105409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).