ethyl N-(2-cyclopentylpyrazol-3-yl)carbamate

C11H17N3O2 — CID 110470599

IUPACethyl N-(2-cyclopentylpyrazol-3-yl)carbamate
SMILESCCOC(=O)Nc1ccnn1C1CCCC1
InChIInChI=1S/C11H17N3O2/c1-2-16-11(15)13-10-7-8-12-14(10)9-5-3-4-6-9/h7-9H,2-6H2,1H3,(H,13,15)
InChIKeyXHKYXBFJPWVNTQ-UHFFFAOYSA-N
MW223.28 g/mol
LogP2.57
Rot. Bonds3

About ethyl N-(2-cyclopentylpyrazol-3-yl)carbamate

ethyl N-(2-cyclopentylpyrazol-3-yl)carbamate (PubChem CID 110470599) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is ethyl N-(2-cyclopentylpyrazol-3-yl)carbamate.

Molecular Properties

Compound Nameethyl N-(2-cyclopentylpyrazol-3-yl)carbamate
PubChem CID110470599
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Nameethyl N-(2-cyclopentylpyrazol-3-yl)carbamate
SMILESCCOC(=O)Nc1ccnn1C1CCCC1
InChIInChI=1S/C11H17N3O2/c1-2-16-11(15)13-10-7-8-12-14(10)9-5-3-4-6-9/h7-9H,2-6H2,1H3,(H,13,15)
InChIKeyXHKYXBFJPWVNTQ-UHFFFAOYSA-N
XLogP2.57
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 1-[2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxoethyl]piperidine-4-carboxylate
CID 8772836
N-(2-cyclopentylpyrazol-3-yl)-2-(4-ethoxyanilino)acetamide
CID 78815624
N-(2-cyclopentylpyrazol-3-yl)-2-methylbenzamide
CID 78793945
[2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxoethyl] 3,4-dimethylbenzoate
CID 8708761
2-chloro-N-(2-cyclobutylpyrazol-3-yl)acetamide
CID 166407634
2-cyano-N-(2-cyclopentylpyrazol-3-yl)acetamide
CID 110470108
[2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxoethyl] 2,4-dimethylbenzoate
CID 8645930
[2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxoethyl] 2,5-dimethylbenzoate
CID 8534684
[2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxoethyl] 2-hydroxy-5-methylbenzoate
CID 16512091
[2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxoethyl]-ethyl-[2-(ethylamino)-2-oxoethyl]azanium
CID 8683008
2-[[2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxoethyl]-ethylamino]-N-ethylacetamide
CID 8683009
N-(2-cyclohexylpyrazol-3-yl)-2-(2-methylimidazol-1-yl)acetamide
CID 46997255

Frequently Asked Questions

What is the IUPAC name of ethyl N-(2-cyclopentylpyrazol-3-yl)carbamate?
The IUPAC name of ethyl N-(2-cyclopentylpyrazol-3-yl)carbamate (CID 110470599) is ethyl N-(2-cyclopentylpyrazol-3-yl)carbamate.
What is the SMILES notation for ethyl N-(2-cyclopentylpyrazol-3-yl)carbamate?
The canonical SMILES for ethyl N-(2-cyclopentylpyrazol-3-yl)carbamate is CCOC(=O)Nc1ccnn1C1CCCC1.
What is the InChIKey of ethyl N-(2-cyclopentylpyrazol-3-yl)carbamate?
The InChIKey is XHKYXBFJPWVNTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-2-16-11(15)13-10-7-8-12-14(10)9-5-3-4-6-9/h7-9H,2-6H2,1H3,(H,13,15).
What are the key properties of ethyl N-(2-cyclopentylpyrazol-3-yl)carbamate?
ethyl N-(2-cyclopentylpyrazol-3-yl)carbamate has a molecular weight of 223.28 g/mol, XLogP of 2.57, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-(2-cyclopentylpyrazol-3-yl)carbamate is sourced from PubChem (CID 110470599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).