2-(2H-indazol-3-yl)-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]ethanone

C19H24N4O3 — CID 47803990

IUPAC2-(2H-indazol-3-yl)-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]ethanone
SMILESO=C(Cc1[nH]nc2ccccc12)N1CCCC(C(=O)N2CCOCC2)C1
InChIInChI=1S/C19H24N4O3/c24-18(12-17-15-5-1-2-6-16(15)20-21-17)23-7-3-4-14(13-23)19(25)22-8-10-26-11-9-22/h1-2,5-6,14H,3-4,7-13H2,(H,20,21)
InChIKeyFDOAPGWMVPQDSD-UHFFFAOYSA-N
MW356.43 g/mol
LogP1.20
Rot. Bonds3

About 2-(2H-indazol-3-yl)-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]ethanone

2-(2H-indazol-3-yl)-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]ethanone (PubChem CID 47803990) has the molecular formula C19H24N4O3 and a molecular weight of 356.43 g/mol. Its IUPAC name is 2-(2H-indazol-3-yl)-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]ethanone.

Molecular Properties

Compound Name2-(2H-indazol-3-yl)-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]ethanone
PubChem CID47803990
Molecular FormulaC19H24N4O3
Molecular Weight356.43 g/mol
Exact Mass356.18
IUPAC Name2-(2H-indazol-3-yl)-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]ethanone
SMILESO=C(Cc1[nH]nc2ccccc12)N1CCCC(C(=O)N2CCOCC2)C1
InChIInChI=1S/C19H24N4O3/c24-18(12-17-15-5-1-2-6-16(15)20-21-17)23-7-3-4-14(13-23)19(25)22-8-10-26-11-9-22/h1-2,5-6,14H,3-4,7-13H2,(H,20,21)
InChIKeyFDOAPGWMVPQDSD-UHFFFAOYSA-N
XLogP1.20
TPSA78.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.43
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-(2H-indazol-3-yl)acetyl]piperidine-4-carboxylic acid
CID 119166712
1-(4-aminopiperidin-1-yl)-2-(2H-indazol-3-yl)ethanone
CID 119375250
1-[3-(morpholine-4-carbonyl)piperidin-1-yl]-2-phenylsulfanylethanone
CID 75838690
1-[(3R)-3-(3,5-dimethyl-1,2,4-triazol-1-yl)piperidin-1-yl]-2-(2H-indazol-3-yl)ethanone
CID 95737187
3-(2H-indazol-3-yl)-1-pyrrolidin-1-ylpropan-1-one
CID 166259361
1-[3-(morpholine-4-carbonyl)piperidin-1-yl]-3-naphthalen-2-ylpropan-1-one
CID 47059658
2-(2H-indazol-3-yl)-1-[3-[3-(2-methoxyethyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]ethanone
CID 45231992
3-(3-methylphenyl)-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one
CID 134000175
2-(2H-indazol-3-yl)-1-piperazin-1-ylethanone;hydrochloride
CID 119402326
1-[(4R,5S)-4-hydroxy-7-azaspiro[4.5]decan-7-yl]-2-(2H-indazol-3-yl)ethanone
CID 135102219
1-[3-(morpholine-4-carbonyl)piperidin-1-yl]-2-(3-phenylpropylsulfonyl)ethanone
CID 55687640
2-[2-(2H-indazol-3-yl)acetyl]-3,4,6,7,8,9a-hexahydro-1H-pyrazino[1,2-a]pyrazin-9-one
CID 50979999

Frequently Asked Questions

What is the IUPAC name of 2-(2H-indazol-3-yl)-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]ethanone?
The IUPAC name of 2-(2H-indazol-3-yl)-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]ethanone (CID 47803990) is 2-(2H-indazol-3-yl)-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]ethanone.
What is the SMILES notation for 2-(2H-indazol-3-yl)-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]ethanone?
The canonical SMILES for 2-(2H-indazol-3-yl)-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]ethanone is O=C(Cc1[nH]nc2ccccc12)N1CCCC(C(=O)N2CCOCC2)C1.
What is the InChIKey of 2-(2H-indazol-3-yl)-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]ethanone?
The InChIKey is FDOAPGWMVPQDSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O3/c24-18(12-17-15-5-1-2-6-16(15)20-21-17)23-7-3-4-14(13-23)19(25)22-8-10-26-11-9-22/h1-2,5-6,14H,3-4,7-13H2,(H,20,21).
What are the key properties of 2-(2H-indazol-3-yl)-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]ethanone?
2-(2H-indazol-3-yl)-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]ethanone has a molecular weight of 356.43 g/mol, XLogP of 1.20, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2H-indazol-3-yl)-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]ethanone is sourced from PubChem (CID 47803990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).