2-(2,2-difluorocyclopentyl)-N-(1H-pyrazol-4-yl)acetamide

C10H13F2N3O — CID 146137593

IUPAC2-(2,2-difluorocyclopentyl)-N-(1H-pyrazol-4-yl)acetamide
SMILESO=C(CC1CCCC1(F)F)Nc1cn[nH]c1
InChIInChI=1S/C10H13F2N3O/c11-10(12)3-1-2-7(10)4-9(16)15-8-5-13-14-6-8/h5-7H,1-4H2,(H,13,14)(H,15,16)
InChIKeyOAEZARZLRRPZRM-UHFFFAOYSA-N
MW229.23 g/mol
LogP2.17
Rot. Bonds3

About 2-(2,2-difluorocyclopentyl)-N-(1H-pyrazol-4-yl)acetamide

2-(2,2-difluorocyclopentyl)-N-(1H-pyrazol-4-yl)acetamide (PubChem CID 146137593) has the molecular formula C10H13F2N3O and a molecular weight of 229.23 g/mol. Its IUPAC name is 2-(2,2-difluorocyclopentyl)-N-(1H-pyrazol-4-yl)acetamide.

Molecular Properties

Compound Name2-(2,2-difluorocyclopentyl)-N-(1H-pyrazol-4-yl)acetamide
PubChem CID146137593
Molecular FormulaC10H13F2N3O
Molecular Weight229.23 g/mol
Exact Mass229.10
IUPAC Name2-(2,2-difluorocyclopentyl)-N-(1H-pyrazol-4-yl)acetamide
SMILESO=C(CC1CCCC1(F)F)Nc1cn[nH]c1
InChIInChI=1S/C10H13F2N3O/c11-10(12)3-1-2-7(10)4-9(16)15-8-5-13-14-6-8/h5-7H,1-4H2,(H,13,14)(H,15,16)
InChIKeyOAEZARZLRRPZRM-UHFFFAOYSA-N
XLogP2.17
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.23
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(1R,5R)-N-methyl-N-(1H-pyrazol-4-yl)bicyclo[3.1.0]hexane-1-carboxamide
CID 154844606
2-(2-bicyclo[2.2.1]heptanyl)-N-(1H-pyrazol-4-yl)acetamide
CID 43429525
(1S)-3,3-difluoro-N-(1-methylpyrazol-4-yl)cyclopentane-1-carboxamide
CID 164637617
N-[5-(difluoromethyl)-1H-pyrazol-4-yl]cyclohexanecarboxamide
CID 139539367
(2S)-2-amino-3-cyclopentyl-N-[1-(difluoromethyl)pyrazol-4-yl]propanamide
CID 177043357
N-(1H-pyrazol-4-yl)cyclohexanecarboxamide
CID 43429406
N-(1H-pyrazol-4-yl)-3-(trifluoromethyl)cyclohexane-1-carboxamide
CID 60506980
4,4,4-trifluoro-N-(1H-pyrazol-4-yl)butanamide
CID 65711581
3-cyclopentyl-N-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]propanamide
CID 75358380
N-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]cyclopentanecarboxamide
CID 75358383
N-(1H-pyrazol-4-yl)-4-(trifluoromethyl)cyclohexane-1-carboxamide
CID 81932742
4,4-difluoro-N-(1H-pyrazol-4-yl)cyclohexane-1-carboxamide
CID 81932743

Frequently Asked Questions

What is the IUPAC name of 2-(2,2-difluorocyclopentyl)-N-(1H-pyrazol-4-yl)acetamide?
The IUPAC name of 2-(2,2-difluorocyclopentyl)-N-(1H-pyrazol-4-yl)acetamide (CID 146137593) is 2-(2,2-difluorocyclopentyl)-N-(1H-pyrazol-4-yl)acetamide.
What is the SMILES notation for 2-(2,2-difluorocyclopentyl)-N-(1H-pyrazol-4-yl)acetamide?
The canonical SMILES for 2-(2,2-difluorocyclopentyl)-N-(1H-pyrazol-4-yl)acetamide is O=C(CC1CCCC1(F)F)Nc1cn[nH]c1.
What is the InChIKey of 2-(2,2-difluorocyclopentyl)-N-(1H-pyrazol-4-yl)acetamide?
The InChIKey is OAEZARZLRRPZRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13F2N3O/c11-10(12)3-1-2-7(10)4-9(16)15-8-5-13-14-6-8/h5-7H,1-4H2,(H,13,14)(H,15,16).
What are the key properties of 2-(2,2-difluorocyclopentyl)-N-(1H-pyrazol-4-yl)acetamide?
2-(2,2-difluorocyclopentyl)-N-(1H-pyrazol-4-yl)acetamide has a molecular weight of 229.23 g/mol, XLogP of 2.17, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-difluorocyclopentyl)-N-(1H-pyrazol-4-yl)acetamide is sourced from PubChem (CID 146137593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).