1-[[2-(1H-pyrazol-5-yl)acetyl]amino]cyclopentane-1-carboxylic acid

C11H15N3O3 — CID 79139388

IUPAC1-[[2-(1H-pyrazol-5-yl)acetyl]amino]cyclopentane-1-carboxylic acid
SMILESO=C(Cc1ccn[nH]1)NC1(C(=O)O)CCCC1
InChIInChI=1S/C11H15N3O3/c15-9(7-8-3-6-12-14-8)13-11(10(16)17)4-1-2-5-11/h3,6H,1-2,4-5,7H2,(H,12,14)(H,13,15)(H,16,17)
InChIKeyOIEDIFGOKFMPEA-UHFFFAOYSA-N
MW237.26 g/mol
LogP0.47
Rot. Bonds4

About 1-[[2-(1H-pyrazol-5-yl)acetyl]amino]cyclopentane-1-carboxylic acid

1-[[2-(1H-pyrazol-5-yl)acetyl]amino]cyclopentane-1-carboxylic acid (PubChem CID 79139388) has the molecular formula C11H15N3O3 and a molecular weight of 237.26 g/mol. Its IUPAC name is 1-[[2-(1H-pyrazol-5-yl)acetyl]amino]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name1-[[2-(1H-pyrazol-5-yl)acetyl]amino]cyclopentane-1-carboxylic acid
PubChem CID79139388
Molecular FormulaC11H15N3O3
Molecular Weight237.26 g/mol
Exact Mass237.11
IUPAC Name1-[[2-(1H-pyrazol-5-yl)acetyl]amino]cyclopentane-1-carboxylic acid
SMILESO=C(Cc1ccn[nH]1)NC1(C(=O)O)CCCC1
InChIInChI=1S/C11H15N3O3/c15-9(7-8-3-6-12-14-8)13-11(10(16)17)4-1-2-5-11/h3,6H,1-2,4-5,7H2,(H,12,14)(H,13,15)(H,16,17)
InChIKeyOIEDIFGOKFMPEA-UHFFFAOYSA-N
XLogP0.47
TPSA95.08 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.26
LogP ≤ 50.47
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(hydroxymethyl)-3-methylcyclohexyl]-2-(1H-pyrazol-5-yl)acetamide
CID 79139213
1-[[2-(4-ethylphenyl)acetyl]amino]cyclopentane-1-carboxylic acid
CID 119176767
1-[[2-(4-methylphenyl)acetyl]amino]cycloheptane-1-carboxylic acid
CID 43341572
1-[[2-(2H-indazol-3-yl)acetyl]amino]cyclohexane-1-carboxylic acid
CID 119168100
1-[[2-(2-fluorophenyl)acetyl]amino]cyclopentane-1-carboxylic acid
CID 43329539
1-[[2-[4-(trifluoromethyl)-3-pyridinyl]acetyl]amino]cyclopentane-1-carboxylic acid
CID 166241496
2-methyl-1-[2-(1H-pyrazol-5-yl)acetyl]piperidine-2-carboxylic acid
CID 104594818
1-[[2-[4-(dimethylamino)phenyl]acetyl]amino]cyclopentane-1-carboxylic acid
CID 91834717
1-[[2-(5-amino-2-pyridinyl)acetyl]amino]cyclopentane-1-carboxylic acid
CID 107338192
N-tert-butyl-2-(1H-pyrazol-5-yl)acetamide
CID 79026363
1-[[2-(6-bromo-2-pyridinyl)acetyl]amino]cyclohexane-1-carboxylic acid
CID 153387632
1-[[2-(3-fluorophenyl)acetyl]amino]cyclopentane-1-carboxylic acid
CID 43329516

Frequently Asked Questions

What is the IUPAC name of 1-[[2-(1H-pyrazol-5-yl)acetyl]amino]cyclopentane-1-carboxylic acid?
The IUPAC name of 1-[[2-(1H-pyrazol-5-yl)acetyl]amino]cyclopentane-1-carboxylic acid (CID 79139388) is 1-[[2-(1H-pyrazol-5-yl)acetyl]amino]cyclopentane-1-carboxylic acid.
What is the SMILES notation for 1-[[2-(1H-pyrazol-5-yl)acetyl]amino]cyclopentane-1-carboxylic acid?
The canonical SMILES for 1-[[2-(1H-pyrazol-5-yl)acetyl]amino]cyclopentane-1-carboxylic acid is O=C(Cc1ccn[nH]1)NC1(C(=O)O)CCCC1.
What is the InChIKey of 1-[[2-(1H-pyrazol-5-yl)acetyl]amino]cyclopentane-1-carboxylic acid?
The InChIKey is OIEDIFGOKFMPEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O3/c15-9(7-8-3-6-12-14-8)13-11(10(16)17)4-1-2-5-11/h3,6H,1-2,4-5,7H2,(H,12,14)(H,13,15)(H,16,17).
What are the key properties of 1-[[2-(1H-pyrazol-5-yl)acetyl]amino]cyclopentane-1-carboxylic acid?
1-[[2-(1H-pyrazol-5-yl)acetyl]amino]cyclopentane-1-carboxylic acid has a molecular weight of 237.26 g/mol, XLogP of 0.47, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[2-(1H-pyrazol-5-yl)acetyl]amino]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 79139388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).