1-[(2R)-2-(3-chlorophenyl)morpholin-4-yl]-2-(1H-pyrazol-5-yl)ethanone

C15H16ClN3O2 — CID 124618430

IUPAC1-[(2R)-2-(3-chlorophenyl)morpholin-4-yl]-2-(1H-pyrazol-5-yl)ethanone
SMILESO=C(Cc1ccn[nH]1)N1CCO[C@H](c2cccc(Cl)c2)C1
InChIInChI=1S/C15H16ClN3O2/c16-12-3-1-2-11(8-12)14-10-19(6-7-21-14)15(20)9-13-4-5-17-18-13/h1-5,8,14H,6-7,9-10H2,(H,17,18)/t14-/m0/s1
InChIKeyGZVJZXUYEJTSRG-AWEZNQCLSA-N
MW305.76 g/mol
LogP2.21
Rot. Bonds3

About 1-[(2R)-2-(3-chlorophenyl)morpholin-4-yl]-2-(1H-pyrazol-5-yl)ethanone

1-[(2R)-2-(3-chlorophenyl)morpholin-4-yl]-2-(1H-pyrazol-5-yl)ethanone (PubChem CID 124618430) has the molecular formula C15H16ClN3O2 and a molecular weight of 305.76 g/mol. Its IUPAC name is 1-[(2R)-2-(3-chlorophenyl)morpholin-4-yl]-2-(1H-pyrazol-5-yl)ethanone.

Molecular Properties

Compound Name1-[(2R)-2-(3-chlorophenyl)morpholin-4-yl]-2-(1H-pyrazol-5-yl)ethanone
PubChem CID124618430
Molecular FormulaC15H16ClN3O2
Molecular Weight305.76 g/mol
Exact Mass305.09
IUPAC Name1-[(2R)-2-(3-chlorophenyl)morpholin-4-yl]-2-(1H-pyrazol-5-yl)ethanone
SMILESO=C(Cc1ccn[nH]1)N1CCO[C@H](c2cccc(Cl)c2)C1
InChIInChI=1S/C15H16ClN3O2/c16-12-3-1-2-11(8-12)14-10-19(6-7-21-14)15(20)9-13-4-5-17-18-13/h1-5,8,14H,6-7,9-10H2,(H,17,18)/t14-/m0/s1
InChIKeyGZVJZXUYEJTSRG-AWEZNQCLSA-N
XLogP2.21
TPSA58.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.76
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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N-[3-[2-(3-chlorophenyl)morpholin-4-yl]-3-oxopropyl]acetamide
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1-[(2S)-2-(3-chlorophenyl)morpholin-4-yl]-5-methylsulfanylpentan-1-one
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CID 110416762
1-[2-(3-chlorophenyl)morpholin-4-yl]-3-(furan-2-yl)propan-1-one
CID 110356623
1-[2-(3-chlorophenyl)morpholin-4-yl]-3-(1,1-dioxothiolan-3-yl)propan-1-one
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[2-(3-chlorophenyl)morpholin-4-yl]-[3-(methoxymethyl)phenyl]methanone
CID 122138903
1-[2-(3,4-dichlorophenyl)morpholin-4-yl]-2-thiophen-2-ylethanone
CID 110364311
[2-(3-chlorophenyl)morpholin-4-yl]-(5-phenyl-1,2-oxazol-3-yl)methanone
CID 110356637
2-(8-azabicyclo[3.2.1]octan-3-yl)-1-[2-(3-bromophenyl)morpholin-4-yl]ethanone;hydrochloride
CID 119757086
2-(3-chlorophenyl)-N-[(1R,2S)-2-methoxy-2-methylcyclopropyl]morpholine-4-carboxamide
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Frequently Asked Questions

What is the IUPAC name of 1-[(2R)-2-(3-chlorophenyl)morpholin-4-yl]-2-(1H-pyrazol-5-yl)ethanone?
The IUPAC name of 1-[(2R)-2-(3-chlorophenyl)morpholin-4-yl]-2-(1H-pyrazol-5-yl)ethanone (CID 124618430) is 1-[(2R)-2-(3-chlorophenyl)morpholin-4-yl]-2-(1H-pyrazol-5-yl)ethanone.
What is the SMILES notation for 1-[(2R)-2-(3-chlorophenyl)morpholin-4-yl]-2-(1H-pyrazol-5-yl)ethanone?
The canonical SMILES for 1-[(2R)-2-(3-chlorophenyl)morpholin-4-yl]-2-(1H-pyrazol-5-yl)ethanone is O=C(Cc1ccn[nH]1)N1CCO[C@H](c2cccc(Cl)c2)C1.
What is the InChIKey of 1-[(2R)-2-(3-chlorophenyl)morpholin-4-yl]-2-(1H-pyrazol-5-yl)ethanone?
The InChIKey is GZVJZXUYEJTSRG-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H16ClN3O2/c16-12-3-1-2-11(8-12)14-10-19(6-7-21-14)15(20)9-13-4-5-17-18-13/h1-5,8,14H,6-7,9-10H2,(H,17,18)/t14-/m0/s1.
What are the key properties of 1-[(2R)-2-(3-chlorophenyl)morpholin-4-yl]-2-(1H-pyrazol-5-yl)ethanone?
1-[(2R)-2-(3-chlorophenyl)morpholin-4-yl]-2-(1H-pyrazol-5-yl)ethanone has a molecular weight of 305.76 g/mol, XLogP of 2.21, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2R)-2-(3-chlorophenyl)morpholin-4-yl]-2-(1H-pyrazol-5-yl)ethanone is sourced from PubChem (CID 124618430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).