2-[4-(2-bicyclo[2.2.1]heptanylamino)pyrazol-1-yl]acetamide

C12H18N4O — CID 61308221

IUPAC2-[4-(2-bicyclo[2.2.1]heptanylamino)pyrazol-1-yl]acetamide
SMILESNC(=O)Cn1cc(NC2CC3CCC2C3)cn1
InChIInChI=1S/C12H18N4O/c13-12(17)7-16-6-10(5-14-16)15-11-4-8-1-2-9(11)3-8/h5-6,8-9,11,15H,1-4,7H2,(H2,13,17)
InChIKeyJHXPELARHCOAAF-UHFFFAOYSA-N
MW234.30 g/mol
LogP0.97
Rot. Bonds4

About 2-[4-(2-bicyclo[2.2.1]heptanylamino)pyrazol-1-yl]acetamide

2-[4-(2-bicyclo[2.2.1]heptanylamino)pyrazol-1-yl]acetamide (PubChem CID 61308221) has the molecular formula C12H18N4O and a molecular weight of 234.30 g/mol. Its IUPAC name is 2-[4-(2-bicyclo[2.2.1]heptanylamino)pyrazol-1-yl]acetamide.

Molecular Properties

Compound Name2-[4-(2-bicyclo[2.2.1]heptanylamino)pyrazol-1-yl]acetamide
PubChem CID61308221
Molecular FormulaC12H18N4O
Molecular Weight234.30 g/mol
Exact Mass234.15
IUPAC Name2-[4-(2-bicyclo[2.2.1]heptanylamino)pyrazol-1-yl]acetamide
SMILESNC(=O)Cn1cc(NC2CC3CCC2C3)cn1
InChIInChI=1S/C12H18N4O/c13-12(17)7-16-6-10(5-14-16)15-11-4-8-1-2-9(11)3-8/h5-6,8-9,11,15H,1-4,7H2,(H2,13,17)
InChIKeyJHXPELARHCOAAF-UHFFFAOYSA-N
XLogP0.97
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-(cycloheptylamino)pyrazol-1-yl]acetamide
CID 43695123
N-(2-bicyclo[2.2.1]heptanyl)-1-methylpyrazol-4-amine
CID 61308966
N-[(1R,2S,4R)-2-bicyclo[2.2.1]heptanyl]-1-methylpyrazol-4-amine
CID 98119478
2-[4-[(1-acetylpiperidin-4-yl)amino]pyrazol-1-yl]acetamide
CID 43783533
9-amino-N-[1-(2-amino-2-oxoethyl)pyrazol-4-yl]bicyclo[3.3.1]nonane-3-carboxamide
CID 120986139
2-[4-(2-bicyclo[2.2.1]heptanylamino)phenoxy]acetamide
CID 61308415
N-[1-(2-amino-2-oxoethyl)pyrazol-4-yl]-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxamide
CID 43705836
2-[4-(butylamino)pyrazol-1-yl]acetamide
CID 43695314
3-[4-(2-bicyclo[2.2.1]heptanylamino)phenoxy]propanamide
CID 61308781
2-[4-(1-cyclohexylethylamino)pyrazol-1-yl]acetamide
CID 43783565
(1S,2S,4S)-N-(1-ethylpyrazol-4-yl)bicyclo[2.2.1]heptane-2-carboxamide
CID 100569266
2-[4-(methanesulfonamido)pyrazol-1-yl]acetamide
CID 61062005

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-bicyclo[2.2.1]heptanylamino)pyrazol-1-yl]acetamide?
The IUPAC name of 2-[4-(2-bicyclo[2.2.1]heptanylamino)pyrazol-1-yl]acetamide (CID 61308221) is 2-[4-(2-bicyclo[2.2.1]heptanylamino)pyrazol-1-yl]acetamide.
What is the SMILES notation for 2-[4-(2-bicyclo[2.2.1]heptanylamino)pyrazol-1-yl]acetamide?
The canonical SMILES for 2-[4-(2-bicyclo[2.2.1]heptanylamino)pyrazol-1-yl]acetamide is NC(=O)Cn1cc(NC2CC3CCC2C3)cn1.
What is the InChIKey of 2-[4-(2-bicyclo[2.2.1]heptanylamino)pyrazol-1-yl]acetamide?
The InChIKey is JHXPELARHCOAAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O/c13-12(17)7-16-6-10(5-14-16)15-11-4-8-1-2-9(11)3-8/h5-6,8-9,11,15H,1-4,7H2,(H2,13,17).
What are the key properties of 2-[4-(2-bicyclo[2.2.1]heptanylamino)pyrazol-1-yl]acetamide?
2-[4-(2-bicyclo[2.2.1]heptanylamino)pyrazol-1-yl]acetamide has a molecular weight of 234.30 g/mol, XLogP of 0.97, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-bicyclo[2.2.1]heptanylamino)pyrazol-1-yl]acetamide is sourced from PubChem (CID 61308221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).