1-ethyl-N-[1-(1H-pyrazol-4-yl)ethyl]cyclopentane-1-carboxamide

C13H21N3O — CID 103856241

IUPAC1-ethyl-N-[1-(1H-pyrazol-4-yl)ethyl]cyclopentane-1-carboxamide
SMILESCCC1(C(=O)NC(C)c2cn[nH]c2)CCCC1
InChIInChI=1S/C13H21N3O/c1-3-13(6-4-5-7-13)12(17)16-10(2)11-8-14-15-9-11/h8-10H,3-7H2,1-2H3,(H,14,15)(H,16,17)
InChIKeyOHNDAYINUDEGCO-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.56
Rot. Bonds4

About 1-ethyl-N-[1-(1H-pyrazol-4-yl)ethyl]cyclopentane-1-carboxamide

1-ethyl-N-[1-(1H-pyrazol-4-yl)ethyl]cyclopentane-1-carboxamide (PubChem CID 103856241) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is 1-ethyl-N-[1-(1H-pyrazol-4-yl)ethyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-ethyl-N-[1-(1H-pyrazol-4-yl)ethyl]cyclopentane-1-carboxamide
PubChem CID103856241
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC Name1-ethyl-N-[1-(1H-pyrazol-4-yl)ethyl]cyclopentane-1-carboxamide
SMILESCCC1(C(=O)NC(C)c2cn[nH]c2)CCCC1
InChIInChI=1S/C13H21N3O/c1-3-13(6-4-5-7-13)12(17)16-10(2)11-8-14-15-9-11/h8-10H,3-7H2,1-2H3,(H,14,15)(H,16,17)
InChIKeyOHNDAYINUDEGCO-UHFFFAOYSA-N
XLogP2.56
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-amino-N-[1-(1H-pyrazol-4-yl)ethyl]cyclopentane-1-carboxamide
CID 106212912
1-amino-N-[1-(1H-pyrazol-4-yl)ethyl]cyclohexane-1-carboxamide
CID 114158937
1-(aminomethyl)-3-methyl-N-[1-(1H-pyrazol-4-yl)ethyl]cyclobutane-1-carboxamide
CID 106217378
1-(N'-hydroxycarbamimidoyl)-N-[1-(1H-pyrazol-4-yl)ethyl]cyclopropane-1-carboxamide
CID 114159621
3-ethyl-N-(1-pyridin-4-ylethyl)piperidine-3-carboxamide
CID 63130581
3-ethyl-N-(1-phenylethyl)piperidine-3-carboxamide
CID 63132202
N-[1-(1H-pyrazol-4-yl)ethyl]butanamide
CID 103856506
2-[1-[1-(1H-pyrazol-4-yl)ethylcarbamoylamino]cyclohexyl]acetic acid
CID 106215471
2-(2-oxoazepan-1-yl)-N-[1-(1H-pyrazol-4-yl)ethyl]acetamide
CID 103856148
methyl 2-[1-(1H-pyrazol-4-yl)ethylamino]butanoate
CID 104953289
3-chloro-2-methyl-N-[1-(1H-pyrazol-4-yl)ethyl]propanamide
CID 106211094
3-amino-2-methyl-N-[1-(1H-pyrazol-4-yl)ethyl]propanamide
CID 106212688

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-[1-(1H-pyrazol-4-yl)ethyl]cyclopentane-1-carboxamide?
The IUPAC name of 1-ethyl-N-[1-(1H-pyrazol-4-yl)ethyl]cyclopentane-1-carboxamide (CID 103856241) is 1-ethyl-N-[1-(1H-pyrazol-4-yl)ethyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 1-ethyl-N-[1-(1H-pyrazol-4-yl)ethyl]cyclopentane-1-carboxamide?
The canonical SMILES for 1-ethyl-N-[1-(1H-pyrazol-4-yl)ethyl]cyclopentane-1-carboxamide is CCC1(C(=O)NC(C)c2cn[nH]c2)CCCC1.
What is the InChIKey of 1-ethyl-N-[1-(1H-pyrazol-4-yl)ethyl]cyclopentane-1-carboxamide?
The InChIKey is OHNDAYINUDEGCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-3-13(6-4-5-7-13)12(17)16-10(2)11-8-14-15-9-11/h8-10H,3-7H2,1-2H3,(H,14,15)(H,16,17).
What are the key properties of 1-ethyl-N-[1-(1H-pyrazol-4-yl)ethyl]cyclopentane-1-carboxamide?
1-ethyl-N-[1-(1H-pyrazol-4-yl)ethyl]cyclopentane-1-carboxamide has a molecular weight of 235.33 g/mol, XLogP of 2.56, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-[1-(1H-pyrazol-4-yl)ethyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 103856241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).