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

C13H24N4O — CID 82985272

IUPACN-[2-(4-aminopyrazol-1-yl)ethyl]-2-propylpentanamide
SMILESCCCC(CCC)C(=O)NCCn1cc(N)cn1
InChIInChI=1S/C13H24N4O/c1-3-5-11(6-4-2)13(18)15-7-8-17-10-12(14)9-16-17/h9-11H,3-8,14H2,1-2H3,(H,15,18)
InChIKeyXPAKWHMPZMXFMY-UHFFFAOYSA-N
MW252.36 g/mol
LogP1.80
Rot. Bonds8

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

N-[2-(4-aminopyrazol-1-yl)ethyl]-2-propylpentanamide (PubChem CID 82985272) has the molecular formula C13H24N4O and a molecular weight of 252.36 g/mol. Its IUPAC name is N-[2-(4-aminopyrazol-1-yl)ethyl]-2-propylpentanamide.

Molecular Properties

Compound NameN-[2-(4-aminopyrazol-1-yl)ethyl]-2-propylpentanamide
PubChem CID82985272
Molecular FormulaC13H24N4O
Molecular Weight252.36 g/mol
Exact Mass252.20
IUPAC NameN-[2-(4-aminopyrazol-1-yl)ethyl]-2-propylpentanamide
SMILESCCCC(CCC)C(=O)NCCn1cc(N)cn1
InChIInChI=1S/C13H24N4O/c1-3-5-11(6-4-2)13(18)15-7-8-17-10-12(14)9-16-17/h9-11H,3-8,14H2,1-2H3,(H,15,18)
InChIKeyXPAKWHMPZMXFMY-UHFFFAOYSA-N
XLogP1.80
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(4-aminopyrazol-1-yl)ethyl]-4-methylpentanamide
CID 115319745
N-[2-(4-aminopyrazol-1-yl)ethyl]-2-methylsulfonylacetamide
CID 115319573
N-[2-(4-aminopyrazol-1-yl)ethyl]benzamide
CID 115319572
N-[2-(4-aminopyrazol-1-yl)ethyl]-1-methylimidazole-4-carboxamide
CID 107971078
N-[2-(4-aminopyrazol-1-yl)ethyl]-2,6-difluorobenzamide
CID 115319778
N-[2-(4-aminopyrazol-1-yl)ethyl]-1,3,5-trimethylpyrazole-4-carboxamide
CID 115319552
N-[2-(4-aminopyrazol-1-yl)ethyl]propane-1-sulfonamide
CID 115319872
N-[2-(4-aminopyrazol-1-yl)ethyl]-2,2,3,3-tetrafluoropropanamide
CID 114032446
N-[2-(4-aminopyrazol-1-yl)ethyl]-2-hydroxybenzamide
CID 115319755
N-[2-(4-aminopyrazol-1-yl)ethyl]-4-methylsulfanylbenzamide
CID 115319726
N-[2-(4-aminopyrazol-1-yl)ethyl]-5-chloro-2-methylbenzamide
CID 82881102
N-[2-(4-aminopyrazol-1-yl)ethyl]-5-bromopyridine-3-carboxamide
CID 113285893

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-aminopyrazol-1-yl)ethyl]-2-propylpentanamide?
The IUPAC name of N-[2-(4-aminopyrazol-1-yl)ethyl]-2-propylpentanamide (CID 82985272) is N-[2-(4-aminopyrazol-1-yl)ethyl]-2-propylpentanamide.
What is the SMILES notation for N-[2-(4-aminopyrazol-1-yl)ethyl]-2-propylpentanamide?
The canonical SMILES for N-[2-(4-aminopyrazol-1-yl)ethyl]-2-propylpentanamide is CCCC(CCC)C(=O)NCCn1cc(N)cn1.
What is the InChIKey of N-[2-(4-aminopyrazol-1-yl)ethyl]-2-propylpentanamide?
The InChIKey is XPAKWHMPZMXFMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4O/c1-3-5-11(6-4-2)13(18)15-7-8-17-10-12(14)9-16-17/h9-11H,3-8,14H2,1-2H3,(H,15,18).
What are the key properties of N-[2-(4-aminopyrazol-1-yl)ethyl]-2-propylpentanamide?
N-[2-(4-aminopyrazol-1-yl)ethyl]-2-propylpentanamide has a molecular weight of 252.36 g/mol, XLogP of 1.80, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-aminopyrazol-1-yl)ethyl]-2-propylpentanamide is sourced from PubChem (CID 82985272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).