N-[2-(4-aminopyrazol-1-yl)ethyl]-2,2-dimethylcyclopropane-1-carboxamide

C11H18N4O — CID 107000294

IUPACN-[2-(4-aminopyrazol-1-yl)ethyl]-2,2-dimethylcyclopropane-1-carboxamide
SMILESCC1(C)CC1C(=O)NCCn1cc(N)cn1
InChIInChI=1S/C11H18N4O/c1-11(2)5-9(11)10(16)13-3-4-15-7-8(12)6-14-15/h6-7,9H,3-5,12H2,1-2H3,(H,13,16)
InChIKeyIVUYWPOCVIBDBB-UHFFFAOYSA-N
MW222.29 g/mol
LogP0.63
Rot. Bonds4

About N-[2-(4-aminopyrazol-1-yl)ethyl]-2,2-dimethylcyclopropane-1-carboxamide

N-[2-(4-aminopyrazol-1-yl)ethyl]-2,2-dimethylcyclopropane-1-carboxamide (PubChem CID 107000294) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is N-[2-(4-aminopyrazol-1-yl)ethyl]-2,2-dimethylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-[2-(4-aminopyrazol-1-yl)ethyl]-2,2-dimethylcyclopropane-1-carboxamide
PubChem CID107000294
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC NameN-[2-(4-aminopyrazol-1-yl)ethyl]-2,2-dimethylcyclopropane-1-carboxamide
SMILESCC1(C)CC1C(=O)NCCn1cc(N)cn1
InChIInChI=1S/C11H18N4O/c1-11(2)5-9(11)10(16)13-3-4-15-7-8(12)6-14-15/h6-7,9H,3-5,12H2,1-2H3,(H,13,16)
InChIKeyIVUYWPOCVIBDBB-UHFFFAOYSA-N
XLogP0.63
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 50.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(4-aminopyrazol-1-yl)ethyl]bicyclo[3.1.0]hexane-6-carboxamide
CID 115319625
N-[2-(4-aminopyrazol-1-yl)ethyl]bicyclo[2.2.1]heptane-2-carboxamide
CID 113285930
N-[2-(4-aminopyrazol-1-yl)ethyl]-2-methylsulfonylacetamide
CID 115319573
1-[2-(4-aminopyrazol-1-yl)ethyl]-3-cyclopentylurea
CID 113285954
1-[3-(2,2-dimethylcyclopropyl)propyl]pyrazol-4-amine
CID 165481618
N-[2-(4-aminopyrazol-1-yl)ethyl]-2-propylpentanamide
CID 82985272
N-[2-(4-aminopyrazol-1-yl)ethyl]-4-methylpentanamide
CID 115319745
N-[2-(4-aminopyrazol-1-yl)ethyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide
CID 115319686
N-[2-(4-aminopyrazol-1-yl)ethyl]-1-(2-methylpropyl)cyclopentane-1-carboxamide
CID 115319550
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

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-aminopyrazol-1-yl)ethyl]-2,2-dimethylcyclopropane-1-carboxamide?
The IUPAC name of N-[2-(4-aminopyrazol-1-yl)ethyl]-2,2-dimethylcyclopropane-1-carboxamide (CID 107000294) is N-[2-(4-aminopyrazol-1-yl)ethyl]-2,2-dimethylcyclopropane-1-carboxamide.
What is the SMILES notation for N-[2-(4-aminopyrazol-1-yl)ethyl]-2,2-dimethylcyclopropane-1-carboxamide?
The canonical SMILES for N-[2-(4-aminopyrazol-1-yl)ethyl]-2,2-dimethylcyclopropane-1-carboxamide is CC1(C)CC1C(=O)NCCn1cc(N)cn1.
What is the InChIKey of N-[2-(4-aminopyrazol-1-yl)ethyl]-2,2-dimethylcyclopropane-1-carboxamide?
The InChIKey is IVUYWPOCVIBDBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-11(2)5-9(11)10(16)13-3-4-15-7-8(12)6-14-15/h6-7,9H,3-5,12H2,1-2H3,(H,13,16).
What are the key properties of N-[2-(4-aminopyrazol-1-yl)ethyl]-2,2-dimethylcyclopropane-1-carboxamide?
N-[2-(4-aminopyrazol-1-yl)ethyl]-2,2-dimethylcyclopropane-1-carboxamide has a molecular weight of 222.29 g/mol, XLogP of 0.63, 4 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]-2,2-dimethylcyclopropane-1-carboxamide is sourced from PubChem (CID 107000294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).