N-(6-fluoro-2-pyridinyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide

C15H21FN2O — CID 113456865

IUPACN-(6-fluoro-2-pyridinyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide
SMILESCC(C)CC1(C(=O)Nc2cccc(F)n2)CCCC1
InChIInChI=1S/C15H21FN2O/c1-11(2)10-15(8-3-4-9-15)14(19)18-13-7-5-6-12(16)17-13/h5-7,11H,3-4,8-10H2,1-2H3,(H,17,18,19)
InChIKeyFOFHRPMWELZDRY-UHFFFAOYSA-N
MW264.34 g/mol
LogP3.77
Rot. Bonds4

About N-(6-fluoro-2-pyridinyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide

N-(6-fluoro-2-pyridinyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide (PubChem CID 113456865) has the molecular formula C15H21FN2O and a molecular weight of 264.34 g/mol. Its IUPAC name is N-(6-fluoro-2-pyridinyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-(6-fluoro-2-pyridinyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide
PubChem CID113456865
Molecular FormulaC15H21FN2O
Molecular Weight264.34 g/mol
Exact Mass264.16
IUPAC NameN-(6-fluoro-2-pyridinyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide
SMILESCC(C)CC1(C(=O)Nc2cccc(F)n2)CCCC1
InChIInChI=1S/C15H21FN2O/c1-11(2)10-15(8-3-4-9-15)14(19)18-13-7-5-6-12(16)17-13/h5-7,11H,3-4,8-10H2,1-2H3,(H,17,18,19)
InChIKeyFOFHRPMWELZDRY-UHFFFAOYSA-N
XLogP3.77
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.34
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(6-fluoro-2-pyridinyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide?
The IUPAC name of N-(6-fluoro-2-pyridinyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide (CID 113456865) is N-(6-fluoro-2-pyridinyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide.
What is the SMILES notation for N-(6-fluoro-2-pyridinyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide?
The canonical SMILES for N-(6-fluoro-2-pyridinyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide is CC(C)CC1(C(=O)Nc2cccc(F)n2)CCCC1.
What is the InChIKey of N-(6-fluoro-2-pyridinyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide?
The InChIKey is FOFHRPMWELZDRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O/c1-11(2)10-15(8-3-4-9-15)14(19)18-13-7-5-6-12(16)17-13/h5-7,11H,3-4,8-10H2,1-2H3,(H,17,18,19).
What are the key properties of N-(6-fluoro-2-pyridinyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide?
N-(6-fluoro-2-pyridinyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide has a molecular weight of 264.34 g/mol, XLogP of 3.77, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-fluoro-2-pyridinyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 113456865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).