2-cyclohexyl-N-(1-methylpyrazol-3-yl)acetamide

C12H19N3O — CID 51228914

IUPAC2-cyclohexyl-N-(1-methylpyrazol-3-yl)acetamide
SMILESCn1ccc(NC(=O)CC2CCCCC2)n1
InChIInChI=1S/C12H19N3O/c1-15-8-7-11(14-15)13-12(16)9-10-5-3-2-4-6-10/h7-8,10H,2-6,9H2,1H3,(H,13,14,16)
InChIKeyPKIWSFKDECNGOY-UHFFFAOYSA-N
MW221.30 g/mol
LogP2.33
Rot. Bonds3

About 2-cyclohexyl-N-(1-methylpyrazol-3-yl)acetamide

2-cyclohexyl-N-(1-methylpyrazol-3-yl)acetamide (PubChem CID 51228914) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is 2-cyclohexyl-N-(1-methylpyrazol-3-yl)acetamide.

Molecular Properties

Compound Name2-cyclohexyl-N-(1-methylpyrazol-3-yl)acetamide
PubChem CID51228914
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name2-cyclohexyl-N-(1-methylpyrazol-3-yl)acetamide
SMILESCn1ccc(NC(=O)CC2CCCCC2)n1
InChIInChI=1S/C12H19N3O/c1-15-8-7-11(14-15)13-12(16)9-10-5-3-2-4-6-10/h7-8,10H,2-6,9H2,1H3,(H,13,14,16)
InChIKeyPKIWSFKDECNGOY-UHFFFAOYSA-N
XLogP2.33
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-methylpyrazol-3-yl)-2-piperidin-4-ylacetamide;hydrochloride
CID 119693548
2-(azetidin-3-yl)-N-(1-methylpyrazol-3-yl)acetamide
CID 64618955
2-cyclohexyl-1-(1-methylpyrazol-3-yl)ethanone
CID 65195414
2-(4-aminopiperidin-1-yl)-N-(1-methylpyrazol-3-yl)acetamide
CID 79327473
N-(1-methylpyrazol-3-yl)cyclopropanecarboxamide
CID 19405001
2-cyclopentyl-1-(1-methylpyrazol-3-yl)ethanone
CID 65195587
N-(1-methylpyrazol-3-yl)-2-piperidin-4-ylsulfanylacetamide
CID 114626846
1-cyclopropyl-3-(1-methylpyrazol-3-yl)urea
CID 115576603
2-[(4aR,8aR)-2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazin-4-yl]-N-(1-methylpyrazol-3-yl)acetamide
CID 91830392
(2R)-2-(2-methylpropyl)-N-(1-methylpyrazol-3-yl)azepane-1-carboxamide
CID 95635629
N-(1-ethylpyrazol-3-yl)-2-piperidin-4-ylacetamide
CID 66510151
(2S)-3-cyclopentyl-N-(1-methylpyrazol-3-yl)-2-[3-(trifluoromethyl)pyrazol-1-yl]propanamide
CID 67312887

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-N-(1-methylpyrazol-3-yl)acetamide?
The IUPAC name of 2-cyclohexyl-N-(1-methylpyrazol-3-yl)acetamide (CID 51228914) is 2-cyclohexyl-N-(1-methylpyrazol-3-yl)acetamide.
What is the SMILES notation for 2-cyclohexyl-N-(1-methylpyrazol-3-yl)acetamide?
The canonical SMILES for 2-cyclohexyl-N-(1-methylpyrazol-3-yl)acetamide is Cn1ccc(NC(=O)CC2CCCCC2)n1.
What is the InChIKey of 2-cyclohexyl-N-(1-methylpyrazol-3-yl)acetamide?
The InChIKey is PKIWSFKDECNGOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-15-8-7-11(14-15)13-12(16)9-10-5-3-2-4-6-10/h7-8,10H,2-6,9H2,1H3,(H,13,14,16).
What are the key properties of 2-cyclohexyl-N-(1-methylpyrazol-3-yl)acetamide?
2-cyclohexyl-N-(1-methylpyrazol-3-yl)acetamide has a molecular weight of 221.30 g/mol, XLogP of 2.33, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-N-(1-methylpyrazol-3-yl)acetamide is sourced from PubChem (CID 51228914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).