2-(4-aminopyrazol-1-yl)-N-[2-(1-methylpiperidin-4-yl)ethyl]acetamide

C13H23N5O — CID 114514841

IUPAC2-(4-aminopyrazol-1-yl)-N-[2-(1-methylpiperidin-4-yl)ethyl]acetamide
SMILESCN1CCC(CCNC(=O)Cn2cc(N)cn2)CC1
InChIInChI=1S/C13H23N5O/c1-17-6-3-11(4-7-17)2-5-15-13(19)10-18-9-12(14)8-16-18/h8-9,11H,2-7,10,14H2,1H3,(H,15,19)
InChIKeyGGFMHIRMCGMWIJ-UHFFFAOYSA-N
MW265.36 g/mol
LogP0.31
Rot. Bonds5

About 2-(4-aminopyrazol-1-yl)-N-[2-(1-methylpiperidin-4-yl)ethyl]acetamide

2-(4-aminopyrazol-1-yl)-N-[2-(1-methylpiperidin-4-yl)ethyl]acetamide (PubChem CID 114514841) has the molecular formula C13H23N5O and a molecular weight of 265.36 g/mol. Its IUPAC name is 2-(4-aminopyrazol-1-yl)-N-[2-(1-methylpiperidin-4-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-(4-aminopyrazol-1-yl)-N-[2-(1-methylpiperidin-4-yl)ethyl]acetamide
PubChem CID114514841
Molecular FormulaC13H23N5O
Molecular Weight265.36 g/mol
Exact Mass265.19
IUPAC Name2-(4-aminopyrazol-1-yl)-N-[2-(1-methylpiperidin-4-yl)ethyl]acetamide
SMILESCN1CCC(CCNC(=O)Cn2cc(N)cn2)CC1
InChIInChI=1S/C13H23N5O/c1-17-6-3-11(4-7-17)2-5-15-13(19)10-18-9-12(14)8-16-18/h8-9,11H,2-7,10,14H2,1H3,(H,15,19)
InChIKeyGGFMHIRMCGMWIJ-UHFFFAOYSA-N
XLogP0.31
TPSA76.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 50.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-aminopyrazol-1-yl)-N-(2-hydroxyethyl)acetamide
CID 43445471
2-(4-aminopyrazol-1-yl)-N-[3-(cyclopropylmethoxy)propyl]acetamide
CID 114097514
2-(4-aminopyrazol-1-yl)-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)acetamide
CID 61115720
4-amino-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide;dihydrochloride
CID 119865905
3-amino-3-methyl-N-[2-(1-methylpiperidin-4-yl)ethyl]butanamide
CID 115740928
3-[[2-(4-aminopyrazol-1-yl)acetyl]amino]-N,N-dimethylpropanamide
CID 61102926
N-[2-(1-methylpiperidin-4-yl)ethyl]-2-phenylacetamide
CID 50875243
tert-butyl N-[3-[[2-(4-aminopyrazol-1-yl)acetyl]amino]propyl]carbamate
CID 114517811
2-(4-aminopyrazol-1-yl)-N-(4-ethylcyclohexyl)acetamide
CID 54955773
2-(3,4-dimethylphenoxy)-N-[2-(1-methylpiperidin-4-yl)ethyl]acetamide
CID 99702462
2-[[2-(4-aminopyrazol-1-yl)acetyl]amino]ethyl carbamate
CID 83201957
N-[2-(1-methylpiperidin-4-yl)ethyl]-2-phenoxyacetamide
CID 50875305

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminopyrazol-1-yl)-N-[2-(1-methylpiperidin-4-yl)ethyl]acetamide?
The IUPAC name of 2-(4-aminopyrazol-1-yl)-N-[2-(1-methylpiperidin-4-yl)ethyl]acetamide (CID 114514841) is 2-(4-aminopyrazol-1-yl)-N-[2-(1-methylpiperidin-4-yl)ethyl]acetamide.
What is the SMILES notation for 2-(4-aminopyrazol-1-yl)-N-[2-(1-methylpiperidin-4-yl)ethyl]acetamide?
The canonical SMILES for 2-(4-aminopyrazol-1-yl)-N-[2-(1-methylpiperidin-4-yl)ethyl]acetamide is CN1CCC(CCNC(=O)Cn2cc(N)cn2)CC1.
What is the InChIKey of 2-(4-aminopyrazol-1-yl)-N-[2-(1-methylpiperidin-4-yl)ethyl]acetamide?
The InChIKey is GGFMHIRMCGMWIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5O/c1-17-6-3-11(4-7-17)2-5-15-13(19)10-18-9-12(14)8-16-18/h8-9,11H,2-7,10,14H2,1H3,(H,15,19).
What are the key properties of 2-(4-aminopyrazol-1-yl)-N-[2-(1-methylpiperidin-4-yl)ethyl]acetamide?
2-(4-aminopyrazol-1-yl)-N-[2-(1-methylpiperidin-4-yl)ethyl]acetamide has a molecular weight of 265.36 g/mol, XLogP of 0.31, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminopyrazol-1-yl)-N-[2-(1-methylpiperidin-4-yl)ethyl]acetamide is sourced from PubChem (CID 114514841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).