2-[4-(cycloheptylamino)pyrazol-1-yl]acetamide

C12H20N4O — CID 43695123

IUPAC2-[4-(cycloheptylamino)pyrazol-1-yl]acetamide
SMILESNC(=O)Cn1cc(NC2CCCCCC2)cn1
InChIInChI=1S/C12H20N4O/c13-12(17)9-16-8-11(7-14-16)15-10-5-3-1-2-4-6-10/h7-8,10,15H,1-6,9H2,(H2,13,17)
InChIKeySNPIFPQMBNXAOR-UHFFFAOYSA-N
MW236.32 g/mol
LogP1.50
Rot. Bonds4

About 2-[4-(cycloheptylamino)pyrazol-1-yl]acetamide

2-[4-(cycloheptylamino)pyrazol-1-yl]acetamide (PubChem CID 43695123) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is 2-[4-(cycloheptylamino)pyrazol-1-yl]acetamide.

Molecular Properties

Compound Name2-[4-(cycloheptylamino)pyrazol-1-yl]acetamide
PubChem CID43695123
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC Name2-[4-(cycloheptylamino)pyrazol-1-yl]acetamide
SMILESNC(=O)Cn1cc(NC2CCCCCC2)cn1
InChIInChI=1S/C12H20N4O/c13-12(17)9-16-8-11(7-14-16)15-10-5-3-1-2-4-6-10/h7-8,10,15H,1-6,9H2,(H2,13,17)
InChIKeySNPIFPQMBNXAOR-UHFFFAOYSA-N
XLogP1.50
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-[(1-acetylpiperidin-4-yl)amino]pyrazol-1-yl]acetamide
CID 43783533
2-[4-(1-cyclohexylethylamino)pyrazol-1-yl]acetamide
CID 43783565
N-cycloheptyl-1-ethylpyrazol-4-amine
CID 43543541
2-[4-(2-bicyclo[2.2.1]heptanylamino)pyrazol-1-yl]acetamide
CID 61308221
N-cyclohexyl-1-(2-methylpropyl)pyrazol-4-amine
CID 115777714
2-[4-[(4-aminocyclohexyl)amino]pyrazol-1-yl]-N-methylacetamide
CID 79730983
1-benzyl-N-cyclohexylpyrazol-4-amine
CID 54866244
1-benzyl-N-cycloheptylpyrazol-4-amine
CID 60931271
N-methyl-2-[4-(thian-4-ylamino)pyrazol-1-yl]acetamide
CID 54866384
2-[4-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)pyrazol-1-yl]-N-methylacetamide
CID 60932315
(3R)-N-[1-(2-amino-2-oxoethyl)pyrazol-4-yl]-3-(methanesulfonamido)piperidine-1-carboxamide
CID 95141524
N-cyclododecyl-1-methylpyrazol-4-amine
CID 43535013

Frequently Asked Questions

What is the IUPAC name of 2-[4-(cycloheptylamino)pyrazol-1-yl]acetamide?
The IUPAC name of 2-[4-(cycloheptylamino)pyrazol-1-yl]acetamide (CID 43695123) is 2-[4-(cycloheptylamino)pyrazol-1-yl]acetamide.
What is the SMILES notation for 2-[4-(cycloheptylamino)pyrazol-1-yl]acetamide?
The canonical SMILES for 2-[4-(cycloheptylamino)pyrazol-1-yl]acetamide is NC(=O)Cn1cc(NC2CCCCCC2)cn1.
What is the InChIKey of 2-[4-(cycloheptylamino)pyrazol-1-yl]acetamide?
The InChIKey is SNPIFPQMBNXAOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c13-12(17)9-16-8-11(7-14-16)15-10-5-3-1-2-4-6-10/h7-8,10,15H,1-6,9H2,(H2,13,17).
What are the key properties of 2-[4-(cycloheptylamino)pyrazol-1-yl]acetamide?
2-[4-(cycloheptylamino)pyrazol-1-yl]acetamide has a molecular weight of 236.32 g/mol, XLogP of 1.50, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(cycloheptylamino)pyrazol-1-yl]acetamide is sourced from PubChem (CID 43695123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).