N-(1-cyclohexyl-5-methylpyrazol-3-yl)-2-morpholin-2-ylacetamide

C16H26N4O2 — CID 141183012

IUPACN-(1-cyclohexyl-5-methylpyrazol-3-yl)-2-morpholin-2-ylacetamide
SMILESCc1cc(NC(=O)CC2CNCCO2)nn1C1CCCCC1
InChIInChI=1S/C16H26N4O2/c1-12-9-15(19-20(12)13-5-3-2-4-6-13)18-16(21)10-14-11-17-7-8-22-14/h9,13-14,17H,2-8,10-11H2,1H3,(H,18,19,21)
InChIKeyZTYLFYNMBRFLON-UHFFFAOYSA-N
MW306.41 g/mol
LogP2.01
Rot. Bonds4

About N-(1-cyclohexyl-5-methylpyrazol-3-yl)-2-morpholin-2-ylacetamide

N-(1-cyclohexyl-5-methylpyrazol-3-yl)-2-morpholin-2-ylacetamide (PubChem CID 141183012) has the molecular formula C16H26N4O2 and a molecular weight of 306.41 g/mol. Its IUPAC name is N-(1-cyclohexyl-5-methylpyrazol-3-yl)-2-morpholin-2-ylacetamide.

Molecular Properties

Compound NameN-(1-cyclohexyl-5-methylpyrazol-3-yl)-2-morpholin-2-ylacetamide
PubChem CID141183012
Molecular FormulaC16H26N4O2
Molecular Weight306.41 g/mol
Exact Mass306.21
IUPAC NameN-(1-cyclohexyl-5-methylpyrazol-3-yl)-2-morpholin-2-ylacetamide
SMILESCc1cc(NC(=O)CC2CNCCO2)nn1C1CCCCC1
InChIInChI=1S/C16H26N4O2/c1-12-9-15(19-20(12)13-5-3-2-4-6-13)18-16(21)10-14-11-17-7-8-22-14/h9,13-14,17H,2-8,10-11H2,1H3,(H,18,19,21)
InChIKeyZTYLFYNMBRFLON-UHFFFAOYSA-N
XLogP2.01
TPSA68.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,5-dimethylpyrazol-3-yl)-2-(2-ethylmorpholin-4-yl)acetamide
CID 45810934
2-[2-[(dimethylamino)methyl]morpholin-4-yl]-N-(2,5-dimethylpyrazol-3-yl)acetamide
CID 53618525
4-(2-methyl-6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-4-yl)-4-oxo-N-(3-propan-2-yloxypropyl)butanamide
CID 46282409
4-{2-Methyl-5-oxo-4H,5H,6H,7H-pyrazolo[1,5-A]pyrimidin-4-YL}-N-[3-(propan-2-yloxy)propyl]butanamide
CID 20928956
N-Cyclohexyl-4-{2-methyl-5-oxo-4H,5H,6H,7H-pyrazolo[1,5-A]pyrimidin-4-YL}butanamide
CID 20928957
N-cyclohexyl-4-(2-methyl-6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-4-yl)-4-oxobutanamide
CID 46282411
(4aS,8aS)-N-(1-cyclohexyl-5-methylpyrazol-3-yl)-3-oxo-4,4a,5,7,8,8a-hexahydropyrido[4,3-b][1,4]oxazine-6-carboxamide
CID 128629932
N-(1-butan-2-yl-5-methylpyrazol-3-yl)-2-ethoxypropanamide
CID 132304540
(2S,3S)-N-(1-cyclohexyl-5-methylpyrazol-3-yl)-3-methyl-1,4-dioxane-2-carboxamide
CID 136586420
(3S)-N-(1-cyclohexyl-5-methylpyrazol-3-yl)oxolane-3-carboxamide
CID 136586422
4-(2-methyl-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4-yl)-N-(3-morpholin-4-ylpropyl)butanamide
CID 20928937
4-(2-methyl-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4-yl)-N-(oxolan-2-ylmethyl)butanamide
CID 20928942

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclohexyl-5-methylpyrazol-3-yl)-2-morpholin-2-ylacetamide?
The IUPAC name of N-(1-cyclohexyl-5-methylpyrazol-3-yl)-2-morpholin-2-ylacetamide (CID 141183012) is N-(1-cyclohexyl-5-methylpyrazol-3-yl)-2-morpholin-2-ylacetamide.
What is the SMILES notation for N-(1-cyclohexyl-5-methylpyrazol-3-yl)-2-morpholin-2-ylacetamide?
The canonical SMILES for N-(1-cyclohexyl-5-methylpyrazol-3-yl)-2-morpholin-2-ylacetamide is Cc1cc(NC(=O)CC2CNCCO2)nn1C1CCCCC1.
What is the InChIKey of N-(1-cyclohexyl-5-methylpyrazol-3-yl)-2-morpholin-2-ylacetamide?
The InChIKey is ZTYLFYNMBRFLON-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O2/c1-12-9-15(19-20(12)13-5-3-2-4-6-13)18-16(21)10-14-11-17-7-8-22-14/h9,13-14,17H,2-8,10-11H2,1H3,(H,18,19,21).
What are the key properties of N-(1-cyclohexyl-5-methylpyrazol-3-yl)-2-morpholin-2-ylacetamide?
N-(1-cyclohexyl-5-methylpyrazol-3-yl)-2-morpholin-2-ylacetamide has a molecular weight of 306.41 g/mol, XLogP of 2.01, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclohexyl-5-methylpyrazol-3-yl)-2-morpholin-2-ylacetamide is sourced from PubChem (CID 141183012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).