2-(4-aminopyrazol-1-yl)-N-(4-ethylcyclohexyl)acetamide

C13H22N4O — CID 54955773

IUPAC2-(4-aminopyrazol-1-yl)-N-(4-ethylcyclohexyl)acetamide
SMILESCCC1CCC(NC(=O)Cn2cc(N)cn2)CC1
InChIInChI=1S/C13H22N4O/c1-2-10-3-5-12(6-4-10)16-13(18)9-17-8-11(14)7-15-17/h7-8,10,12H,2-6,9,14H2,1H3,(H,16,18)
InChIKeyLJQQXPGRCHOGDT-UHFFFAOYSA-N
MW250.35 g/mol
LogP1.55
Rot. Bonds4

About 2-(4-aminopyrazol-1-yl)-N-(4-ethylcyclohexyl)acetamide

2-(4-aminopyrazol-1-yl)-N-(4-ethylcyclohexyl)acetamide (PubChem CID 54955773) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is 2-(4-aminopyrazol-1-yl)-N-(4-ethylcyclohexyl)acetamide.

Molecular Properties

Compound Name2-(4-aminopyrazol-1-yl)-N-(4-ethylcyclohexyl)acetamide
PubChem CID54955773
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC Name2-(4-aminopyrazol-1-yl)-N-(4-ethylcyclohexyl)acetamide
SMILESCCC1CCC(NC(=O)Cn2cc(N)cn2)CC1
InChIInChI=1S/C13H22N4O/c1-2-10-3-5-12(6-4-10)16-13(18)9-17-8-11(14)7-15-17/h7-8,10,12H,2-6,9,14H2,1H3,(H,16,18)
InChIKeyLJQQXPGRCHOGDT-UHFFFAOYSA-N
XLogP1.55
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-aminopyrazol-1-yl)-N-(oxan-4-yl)acetamide
CID 43609571
2-(4-aminopyrazol-1-yl)-N-(1-ethylpiperidin-3-yl)acetamide
CID 61171325
2-(4-aminopyrazol-1-yl)-N-(2,3-dihydro-1H-inden-2-yl)acetamide
CID 107843288
2-(4-aminopyrazol-1-yl)-N-(2-methyloxolan-3-yl)acetamide
CID 82725311
2-[4-(3-aminophenyl)pyrazol-1-yl]-N-cyclopropylacetamide
CID 63338058
2-(4-amino-3,5-dimethylpyrazol-1-yl)-N-(4-ethylcyclohexyl)acetamide
CID 61466568
2-(4-aminopyrazol-1-yl)-N-(2,2-dimethylcyclopentyl)acetamide
CID 79855019
2-(4-aminopyrazol-1-yl)-N-(5-oxopyrrolidin-3-yl)acetamide
CID 106179815
N-cyclopropyl-2-[4-(propan-2-ylamino)pyrazol-1-yl]acetamide
CID 60931819
N-cyclopropyl-2-[4-(propylsulfonylamino)pyrazol-1-yl]acetamide
CID 61061294
2-(4-aminophenoxy)-N-(4-ethylcyclohexyl)acetamide
CID 61466103
2-(4-aminopyrazol-1-yl)-N-[2-(1-methylpiperidin-4-yl)ethyl]acetamide
CID 114514841

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminopyrazol-1-yl)-N-(4-ethylcyclohexyl)acetamide?
The IUPAC name of 2-(4-aminopyrazol-1-yl)-N-(4-ethylcyclohexyl)acetamide (CID 54955773) is 2-(4-aminopyrazol-1-yl)-N-(4-ethylcyclohexyl)acetamide.
What is the SMILES notation for 2-(4-aminopyrazol-1-yl)-N-(4-ethylcyclohexyl)acetamide?
The canonical SMILES for 2-(4-aminopyrazol-1-yl)-N-(4-ethylcyclohexyl)acetamide is CCC1CCC(NC(=O)Cn2cc(N)cn2)CC1.
What is the InChIKey of 2-(4-aminopyrazol-1-yl)-N-(4-ethylcyclohexyl)acetamide?
The InChIKey is LJQQXPGRCHOGDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-2-10-3-5-12(6-4-10)16-13(18)9-17-8-11(14)7-15-17/h7-8,10,12H,2-6,9,14H2,1H3,(H,16,18).
What are the key properties of 2-(4-aminopyrazol-1-yl)-N-(4-ethylcyclohexyl)acetamide?
2-(4-aminopyrazol-1-yl)-N-(4-ethylcyclohexyl)acetamide has a molecular weight of 250.35 g/mol, XLogP of 1.55, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminopyrazol-1-yl)-N-(4-ethylcyclohexyl)acetamide is sourced from PubChem (CID 54955773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).