N-(1H-pyrazol-5-yl)cyclopentanecarboxamide

C9H13N3O — CID 61393143

IUPACN-(1H-pyrazol-5-yl)cyclopentanecarboxamide
SMILESO=C(Nc1ccn[nH]1)C1CCCC1
InChIInChI=1S/C9H13N3O/c13-9(7-3-1-2-4-7)11-8-5-6-10-12-8/h5-7H,1-4H2,(H2,10,11,12,13)
InChIKeyLTCZATFCJUYDKP-UHFFFAOYSA-N
MW179.22 g/mol
LogP1.54
Rot. Bonds2

About N-(1H-pyrazol-5-yl)cyclopentanecarboxamide

N-(1H-pyrazol-5-yl)cyclopentanecarboxamide (PubChem CID 61393143) has the molecular formula C9H13N3O and a molecular weight of 179.22 g/mol. Its IUPAC name is N-(1H-pyrazol-5-yl)cyclopentanecarboxamide.

Molecular Properties

Compound NameN-(1H-pyrazol-5-yl)cyclopentanecarboxamide
PubChem CID61393143
Molecular FormulaC9H13N3O
Molecular Weight179.22 g/mol
Exact Mass179.11
IUPAC NameN-(1H-pyrazol-5-yl)cyclopentanecarboxamide
SMILESO=C(Nc1ccn[nH]1)C1CCCC1
InChIInChI=1S/C9H13N3O/c13-9(7-3-1-2-4-7)11-8-5-6-10-12-8/h5-7H,1-4H2,(H2,10,11,12,13)
InChIKeyLTCZATFCJUYDKP-UHFFFAOYSA-N
XLogP1.54
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1H-pyrazol-5-yl)cyclopentanecarboxamide?
The IUPAC name of N-(1H-pyrazol-5-yl)cyclopentanecarboxamide (CID 61393143) is N-(1H-pyrazol-5-yl)cyclopentanecarboxamide.
What is the SMILES notation for N-(1H-pyrazol-5-yl)cyclopentanecarboxamide?
The canonical SMILES for N-(1H-pyrazol-5-yl)cyclopentanecarboxamide is O=C(Nc1ccn[nH]1)C1CCCC1.
What is the InChIKey of N-(1H-pyrazol-5-yl)cyclopentanecarboxamide?
The InChIKey is LTCZATFCJUYDKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O/c13-9(7-3-1-2-4-7)11-8-5-6-10-12-8/h5-7H,1-4H2,(H2,10,11,12,13).
What are the key properties of N-(1H-pyrazol-5-yl)cyclopentanecarboxamide?
N-(1H-pyrazol-5-yl)cyclopentanecarboxamide has a molecular weight of 179.22 g/mol, XLogP of 1.54, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-pyrazol-5-yl)cyclopentanecarboxamide is sourced from PubChem (CID 61393143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).