[3-(4-methylpyrazol-1-yl)piperidin-1-yl]-morpholin-2-ylmethanone

C14H22N4O2 — CID 119881486

IUPAC[3-(4-methylpyrazol-1-yl)piperidin-1-yl]-morpholin-2-ylmethanone
SMILESCc1cnn(C2CCCN(C(=O)C3CNCCO3)C2)c1
InChIInChI=1S/C14H22N4O2/c1-11-7-16-18(9-11)12-3-2-5-17(10-12)14(19)13-8-15-4-6-20-13/h7,9,12-13,15H,2-6,8,10H2,1H3
InChIKeyCJWVKTQPOISWFV-UHFFFAOYSA-N
MW278.36 g/mol
LogP0.34
Rot. Bonds2

About [3-(4-methylpyrazol-1-yl)piperidin-1-yl]-morpholin-2-ylmethanone

[3-(4-methylpyrazol-1-yl)piperidin-1-yl]-morpholin-2-ylmethanone (PubChem CID 119881486) has the molecular formula C14H22N4O2 and a molecular weight of 278.36 g/mol. Its IUPAC name is [3-(4-methylpyrazol-1-yl)piperidin-1-yl]-morpholin-2-ylmethanone.

Molecular Properties

Compound Name[3-(4-methylpyrazol-1-yl)piperidin-1-yl]-morpholin-2-ylmethanone
PubChem CID119881486
Molecular FormulaC14H22N4O2
Molecular Weight278.36 g/mol
Exact Mass278.17
IUPAC Name[3-(4-methylpyrazol-1-yl)piperidin-1-yl]-morpholin-2-ylmethanone
SMILESCc1cnn(C2CCCN(C(=O)C3CNCCO3)C2)c1
InChIInChI=1S/C14H22N4O2/c1-11-7-16-18(9-11)12-3-2-5-17(10-12)14(19)13-8-15-4-6-20-13/h7,9,12-13,15H,2-6,8,10H2,1H3
InChIKeyCJWVKTQPOISWFV-UHFFFAOYSA-N
XLogP0.34
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 50.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[(3S)-3-hydroxypiperidin-1-yl]-morpholin-2-ylmethanone
CID 107222846
2-amino-2-methyl-1-[3-(4-methylpyrazol-1-yl)piperidin-1-yl]propan-1-one
CID 119881436
[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]-morpholin-2-ylmethanone;hydrochloride
CID 119775650
[(3R)-3-(4-methylpyrazol-1-yl)piperidin-1-yl]-[(1S,2S)-2-(trifluoromethyl)cyclohexyl]methanone
CID 95284553
2,3,3a,4,5,6,7,7a-octahydro-1H-indol-2-yl-[3-(4-methylpyrazol-1-yl)piperidin-1-yl]methanone;dihydrochloride
CID 119881453
(4R)-1-cyclopropyl-4-[(3S)-3-(4-methylpyrazol-1-yl)piperidine-1-carbonyl]pyrrolidin-2-one
CID 95289665
N-methyl-1-[(3S)-3-(4-methylpyrazol-1-yl)piperidine-1-carbonyl]cyclobutane-1-carboxamide
CID 95280605
3-(4-methylpyrazol-1-yl)-1-[(3R)-3-(4-methylpyrazol-1-yl)piperidin-1-yl]propan-1-one
CID 95289673
3-amino-1-[3-(4-methylpyrazol-1-yl)piperidin-1-yl]butan-1-one
CID 119881484
1-[(4R)-4-[(3R)-3-(4-methylpyrazol-1-yl)piperidine-1-carbonyl]-1,3-thiazolidin-3-yl]ethanone
CID 95281814
[(1R,2S)-2-(furan-2-yl)cyclopropyl]-[(3R)-3-(4-methylpyrazol-1-yl)piperidin-1-yl]methanone
CID 95382967
2-[(4R)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-1-[(3R)-3-(4-methylpyrazol-1-yl)piperidin-1-yl]ethanone
CID 95325187

Frequently Asked Questions

What is the IUPAC name of [3-(4-methylpyrazol-1-yl)piperidin-1-yl]-morpholin-2-ylmethanone?
The IUPAC name of [3-(4-methylpyrazol-1-yl)piperidin-1-yl]-morpholin-2-ylmethanone (CID 119881486) is [3-(4-methylpyrazol-1-yl)piperidin-1-yl]-morpholin-2-ylmethanone.
What is the SMILES notation for [3-(4-methylpyrazol-1-yl)piperidin-1-yl]-morpholin-2-ylmethanone?
The canonical SMILES for [3-(4-methylpyrazol-1-yl)piperidin-1-yl]-morpholin-2-ylmethanone is Cc1cnn(C2CCCN(C(=O)C3CNCCO3)C2)c1.
What is the InChIKey of [3-(4-methylpyrazol-1-yl)piperidin-1-yl]-morpholin-2-ylmethanone?
The InChIKey is CJWVKTQPOISWFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2/c1-11-7-16-18(9-11)12-3-2-5-17(10-12)14(19)13-8-15-4-6-20-13/h7,9,12-13,15H,2-6,8,10H2,1H3.
What are the key properties of [3-(4-methylpyrazol-1-yl)piperidin-1-yl]-morpholin-2-ylmethanone?
[3-(4-methylpyrazol-1-yl)piperidin-1-yl]-morpholin-2-ylmethanone has a molecular weight of 278.36 g/mol, XLogP of 0.34, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(4-methylpyrazol-1-yl)piperidin-1-yl]-morpholin-2-ylmethanone is sourced from PubChem (CID 119881486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).