N-[5-(2-ethylpiperidin-1-yl)-2-pyridinyl]-4-fluorobenzamide

C19H22FN3O — CID 113030675

IUPACN-[5-(2-ethylpiperidin-1-yl)-2-pyridinyl]-4-fluorobenzamide
SMILESCCC1CCCCN1c1ccc(NC(=O)c2ccc(F)cc2)nc1
InChIInChI=1S/C19H22FN3O/c1-2-16-5-3-4-12-23(16)17-10-11-18(21-13-17)22-19(24)14-6-8-15(20)9-7-14/h6-11,13,16H,2-5,12H2,1H3,(H,21,22,24)
InChIKeyVIQWENGVOWXWTQ-UHFFFAOYSA-N
MW327.40 g/mol
LogP4.24
Rot. Bonds4

About N-[5-(2-ethylpiperidin-1-yl)-2-pyridinyl]-4-fluorobenzamide

N-[5-(2-ethylpiperidin-1-yl)-2-pyridinyl]-4-fluorobenzamide (PubChem CID 113030675) has the molecular formula C19H22FN3O and a molecular weight of 327.40 g/mol. Its IUPAC name is N-[5-(2-ethylpiperidin-1-yl)-2-pyridinyl]-4-fluorobenzamide.

Molecular Properties

Compound NameN-[5-(2-ethylpiperidin-1-yl)-2-pyridinyl]-4-fluorobenzamide
PubChem CID113030675
Molecular FormulaC19H22FN3O
Molecular Weight327.40 g/mol
Exact Mass327.17
IUPAC NameN-[5-(2-ethylpiperidin-1-yl)-2-pyridinyl]-4-fluorobenzamide
SMILESCCC1CCCCN1c1ccc(NC(=O)c2ccc(F)cc2)nc1
InChIInChI=1S/C19H22FN3O/c1-2-16-5-3-4-12-23(16)17-10-11-18(21-13-17)22-19(24)14-6-8-15(20)9-7-14/h6-11,13,16H,2-5,12H2,1H3,(H,21,22,24)
InChIKeyVIQWENGVOWXWTQ-UHFFFAOYSA-N
XLogP4.24
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.40
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[5-(2-ethylpiperidin-1-yl)-2-pyridinyl]furan-2-carboxamide
CID 113030667
1-[5-(2-ethylpiperidin-1-yl)-2-pyridinyl]-3-phenylurea
CID 113030715
N-[5-(2-ethylpiperidin-1-yl)-2-pyridinyl]-2-(4-methylphenyl)acetamide
CID 113030714
tert-butyl N-[5-(2-ethylpiperidin-1-yl)-2-pyridinyl]carbamate
CID 113030719
N-[5-(2-ethylpiperidin-1-yl)-2-pyridinyl]-2-(4-methoxyphenyl)acetamide
CID 113030692
N-(4-chlorophenyl)-5-(2-ethylpiperidin-1-yl)pyridine-2-carboxamide
CID 109196262
5-(2-ethylazepan-1-yl)pyridine-2-carboxylic acid
CID 104690117
N-[5-(cyclopentylamino)-2-pyridinyl]-4-fluorobenzamide
CID 113024447
N-(4-ethoxyphenyl)-5-(2-ethylpiperidin-1-yl)pyridine-2-carboxamide
CID 109196271
N'-[5-amino-6-(2-ethylpiperidin-1-yl)pyrimidin-4-yl]-4-fluorobenzohydrazide
CID 19140506
5-(2-ethylpiperidin-1-yl)-N-pentylpyridine-2-carboxamide
CID 109195721
4-fluoro-N-[5-(propan-2-ylamino)-2-pyridinyl]benzamide
CID 113023565

Frequently Asked Questions

What is the IUPAC name of N-[5-(2-ethylpiperidin-1-yl)-2-pyridinyl]-4-fluorobenzamide?
The IUPAC name of N-[5-(2-ethylpiperidin-1-yl)-2-pyridinyl]-4-fluorobenzamide (CID 113030675) is N-[5-(2-ethylpiperidin-1-yl)-2-pyridinyl]-4-fluorobenzamide.
What is the SMILES notation for N-[5-(2-ethylpiperidin-1-yl)-2-pyridinyl]-4-fluorobenzamide?
The canonical SMILES for N-[5-(2-ethylpiperidin-1-yl)-2-pyridinyl]-4-fluorobenzamide is CCC1CCCCN1c1ccc(NC(=O)c2ccc(F)cc2)nc1.
What is the InChIKey of N-[5-(2-ethylpiperidin-1-yl)-2-pyridinyl]-4-fluorobenzamide?
The InChIKey is VIQWENGVOWXWTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22FN3O/c1-2-16-5-3-4-12-23(16)17-10-11-18(21-13-17)22-19(24)14-6-8-15(20)9-7-14/h6-11,13,16H,2-5,12H2,1H3,(H,21,22,24).
What are the key properties of N-[5-(2-ethylpiperidin-1-yl)-2-pyridinyl]-4-fluorobenzamide?
N-[5-(2-ethylpiperidin-1-yl)-2-pyridinyl]-4-fluorobenzamide has a molecular weight of 327.40 g/mol, XLogP of 4.24, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(2-ethylpiperidin-1-yl)-2-pyridinyl]-4-fluorobenzamide is sourced from PubChem (CID 113030675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).