1-[2-(4-aminopyrazol-1-yl)ethyl]-3-cyclopentylurea

C11H19N5O — CID 113285954

IUPAC1-[2-(4-aminopyrazol-1-yl)ethyl]-3-cyclopentylurea
SMILESNc1cnn(CCNC(=O)NC2CCCC2)c1
InChIInChI=1S/C11H19N5O/c12-9-7-14-16(8-9)6-5-13-11(17)15-10-3-1-2-4-10/h7-8,10H,1-6,12H2,(H2,13,15,17)
InChIKeyXLCFDNZNHXUKOA-UHFFFAOYSA-N
MW237.31 g/mol
LogP0.71
Rot. Bonds4

About 1-[2-(4-aminopyrazol-1-yl)ethyl]-3-cyclopentylurea

1-[2-(4-aminopyrazol-1-yl)ethyl]-3-cyclopentylurea (PubChem CID 113285954) has the molecular formula C11H19N5O and a molecular weight of 237.31 g/mol. Its IUPAC name is 1-[2-(4-aminopyrazol-1-yl)ethyl]-3-cyclopentylurea.

Molecular Properties

Compound Name1-[2-(4-aminopyrazol-1-yl)ethyl]-3-cyclopentylurea
PubChem CID113285954
Molecular FormulaC11H19N5O
Molecular Weight237.31 g/mol
Exact Mass237.16
IUPAC Name1-[2-(4-aminopyrazol-1-yl)ethyl]-3-cyclopentylurea
SMILESNc1cnn(CCNC(=O)NC2CCCC2)c1
InChIInChI=1S/C11H19N5O/c12-9-7-14-16(8-9)6-5-13-11(17)15-10-3-1-2-4-10/h7-8,10H,1-6,12H2,(H2,13,15,17)
InChIKeyXLCFDNZNHXUKOA-UHFFFAOYSA-N
XLogP0.71
TPSA84.97 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 50.71
H-Bond Donors ≤ 53
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]-2,2-dimethylcyclopropane-1-carboxamide
CID 107000294
1-cyclopentyl-3-[2-(2,5-dimethylpyrrol-1-yl)ethyl]urea
CID 110747697
1-cyclohexyl-3-[(1-methylpyrazol-4-yl)methyl]urea
CID 2932925
3-[4-(cyclooctylcarbamoyl)pyrazol-1-yl]propanoic acid
CID 19622223
N-[2-(4-aminopyrazol-1-yl)ethyl]bicyclo[2.2.1]heptane-2-carboxamide
CID 113285930
2-(4-aminopyrazol-1-yl)-N-(oxan-4-yl)acetamide
CID 43609571
1-cyclohexyl-3-(2-pyrrol-1-ylethyl)urea
CID 110747679
N-[2-(4-aminopyrazol-1-yl)ethyl]benzamide
CID 115319572
N-[2-(4-aminopyrazol-1-yl)ethyl]-2-methylsulfonylacetamide
CID 115319573
N-[2-(4-aminopyrazol-1-yl)ethyl]-1-methylimidazole-4-carboxamide
CID 107971078
N-[2-(4-aminopyrazol-1-yl)ethyl]-4-methylpentanamide
CID 115319745

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-aminopyrazol-1-yl)ethyl]-3-cyclopentylurea?
The IUPAC name of 1-[2-(4-aminopyrazol-1-yl)ethyl]-3-cyclopentylurea (CID 113285954) is 1-[2-(4-aminopyrazol-1-yl)ethyl]-3-cyclopentylurea.
What is the SMILES notation for 1-[2-(4-aminopyrazol-1-yl)ethyl]-3-cyclopentylurea?
The canonical SMILES for 1-[2-(4-aminopyrazol-1-yl)ethyl]-3-cyclopentylurea is Nc1cnn(CCNC(=O)NC2CCCC2)c1.
What is the InChIKey of 1-[2-(4-aminopyrazol-1-yl)ethyl]-3-cyclopentylurea?
The InChIKey is XLCFDNZNHXUKOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5O/c12-9-7-14-16(8-9)6-5-13-11(17)15-10-3-1-2-4-10/h7-8,10H,1-6,12H2,(H2,13,15,17).
What are the key properties of 1-[2-(4-aminopyrazol-1-yl)ethyl]-3-cyclopentylurea?
1-[2-(4-aminopyrazol-1-yl)ethyl]-3-cyclopentylurea has a molecular weight of 237.31 g/mol, XLogP of 0.71, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-aminopyrazol-1-yl)ethyl]-3-cyclopentylurea is sourced from PubChem (CID 113285954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).