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

C11H20N4O — CID 115319745

IUPACN-[2-(4-aminopyrazol-1-yl)ethyl]-4-methylpentanamide
SMILESCC(C)CCC(=O)NCCn1cc(N)cn1
InChIInChI=1S/C11H20N4O/c1-9(2)3-4-11(16)13-5-6-15-8-10(12)7-14-15/h7-9H,3-6,12H2,1-2H3,(H,13,16)
InChIKeyOTOAOGLJQKVPNP-UHFFFAOYSA-N
MW224.31 g/mol
LogP1.02
Rot. Bonds6

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

N-[2-(4-aminopyrazol-1-yl)ethyl]-4-methylpentanamide (PubChem CID 115319745) has the molecular formula C11H20N4O and a molecular weight of 224.31 g/mol. Its IUPAC name is N-[2-(4-aminopyrazol-1-yl)ethyl]-4-methylpentanamide.

Molecular Properties

Compound NameN-[2-(4-aminopyrazol-1-yl)ethyl]-4-methylpentanamide
PubChem CID115319745
Molecular FormulaC11H20N4O
Molecular Weight224.31 g/mol
Exact Mass224.16
IUPAC NameN-[2-(4-aminopyrazol-1-yl)ethyl]-4-methylpentanamide
SMILESCC(C)CCC(=O)NCCn1cc(N)cn1
InChIInChI=1S/C11H20N4O/c1-9(2)3-4-11(16)13-5-6-15-8-10(12)7-14-15/h7-9H,3-6,12H2,1-2H3,(H,13,16)
InChIKeyOTOAOGLJQKVPNP-UHFFFAOYSA-N
XLogP1.02
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(4-aminopyrazol-1-yl)ethyl]-2-methylsulfonylacetamide
CID 115319573
N-[2-(4-aminopyrazol-1-yl)ethyl]-2-propylpentanamide
CID 82985272
N-[2-(4-aminopyrazol-1-yl)ethyl]-1-(2-methylpropyl)cyclopentane-1-carboxamide
CID 115319550
2-(4-aminopyrazol-1-yl)-N-(2-methylpropyl)acetamide
CID 43185729
N-[2-(4-aminopyrazol-1-yl)ethyl]-2,2,3,3-tetrafluoropropanamide
CID 114032446
N-[2-(4-aminopyrazol-1-yl)ethyl]-2-(2,6-difluorophenyl)acetamide
CID 115319698
N-[2-(4-aminopyrazol-1-yl)ethyl]-2-(3,4-dichlorophenyl)acetamide
CID 115319574
2-(4-aminopyrazol-1-yl)-N-methyl-N-(2-methylpropyl)acetamide
CID 43445500
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]-2,2-dimethylcyclopropane-1-carboxamide
CID 107000294
2-(4-aminopyrazol-1-yl)-N-(2-hydroxyethyl)acetamide
CID 43445471

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-aminopyrazol-1-yl)ethyl]-4-methylpentanamide?
The IUPAC name of N-[2-(4-aminopyrazol-1-yl)ethyl]-4-methylpentanamide (CID 115319745) is N-[2-(4-aminopyrazol-1-yl)ethyl]-4-methylpentanamide.
What is the SMILES notation for N-[2-(4-aminopyrazol-1-yl)ethyl]-4-methylpentanamide?
The canonical SMILES for N-[2-(4-aminopyrazol-1-yl)ethyl]-4-methylpentanamide is CC(C)CCC(=O)NCCn1cc(N)cn1.
What is the InChIKey of N-[2-(4-aminopyrazol-1-yl)ethyl]-4-methylpentanamide?
The InChIKey is OTOAOGLJQKVPNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O/c1-9(2)3-4-11(16)13-5-6-15-8-10(12)7-14-15/h7-9H,3-6,12H2,1-2H3,(H,13,16).
What are the key properties of N-[2-(4-aminopyrazol-1-yl)ethyl]-4-methylpentanamide?
N-[2-(4-aminopyrazol-1-yl)ethyl]-4-methylpentanamide has a molecular weight of 224.31 g/mol, XLogP of 1.02, 6 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]-4-methylpentanamide is sourced from PubChem (CID 115319745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).