N-cyclohexyl-2-ethyl-6-fluoropyridine-4-carboxamide

C14H19FN2O — CID 123798509

IUPACN-cyclohexyl-2-ethyl-6-fluoropyridine-4-carboxamide
SMILESCCc1cc(C(=O)NC2CCCCC2)cc(F)n1
InChIInChI=1S/C14H19FN2O/c1-2-11-8-10(9-13(15)16-11)14(18)17-12-6-4-3-5-7-12/h8-9,12H,2-7H2,1H3,(H,17,18)
InChIKeyDXXYWRNNKLCEFG-UHFFFAOYSA-N
MW250.32 g/mol
LogP2.85
Rot. Bonds3

About N-cyclohexyl-2-ethyl-6-fluoropyridine-4-carboxamide

N-cyclohexyl-2-ethyl-6-fluoropyridine-4-carboxamide (PubChem CID 123798509) has the molecular formula C14H19FN2O and a molecular weight of 250.32 g/mol. Its IUPAC name is N-cyclohexyl-2-ethyl-6-fluoropyridine-4-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-2-ethyl-6-fluoropyridine-4-carboxamide
PubChem CID123798509
Molecular FormulaC14H19FN2O
Molecular Weight250.32 g/mol
Exact Mass250.15
IUPAC NameN-cyclohexyl-2-ethyl-6-fluoropyridine-4-carboxamide
SMILESCCc1cc(C(=O)NC2CCCCC2)cc(F)n1
InChIInChI=1S/C14H19FN2O/c1-2-11-8-10(9-13(15)16-11)14(18)17-12-6-4-3-5-7-12/h8-9,12H,2-7H2,1H3,(H,17,18)
InChIKeyDXXYWRNNKLCEFG-UHFFFAOYSA-N
XLogP2.85
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.32
LogP ≤ 52.85
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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Related Compounds

N-cyclohexyl-2-fluoropyridine-4-carboxamide
CID 59355741
N-cyclohexyl-2-fluoropyridine-4-carboxamide;1,1-diiodoethane
CID 144683851
2,6-dichloro-N-cyclohexylpyridine-4-carboxamide
CID 26719449
N-cycloheptyl-3,5-difluoro-4-(methylamino)benzamide
CID 63187586
4-bromo-N-cyclohexyl-3,5-difluorobenzamide
CID 172646662
3,5-diamino-N-cyclooctylbenzamide
CID 61092511
N-cyclooctyl-4-(propylamino)benzamide
CID 62172072
5-(cyclohexylcarbamoyl)-2-ethylbenzenesulfonyl chloride
CID 65367205
5-N-butan-2-yl-3-N-cycloheptylpyridine-3,5-dicarboxamide
CID 109102356
5-N-cyclohexyl-3-N-propylpyridine-3,5-dicarboxamide
CID 109101138
2-chloro-N-cycloheptyl-6-(methylamino)pyridine-4-carboxamide
CID 62165625
N-cyclooctyl-3,4,5-trimethoxybenzamide
CID 679003

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-ethyl-6-fluoropyridine-4-carboxamide?
The IUPAC name of N-cyclohexyl-2-ethyl-6-fluoropyridine-4-carboxamide (CID 123798509) is N-cyclohexyl-2-ethyl-6-fluoropyridine-4-carboxamide.
What is the SMILES notation for N-cyclohexyl-2-ethyl-6-fluoropyridine-4-carboxamide?
The canonical SMILES for N-cyclohexyl-2-ethyl-6-fluoropyridine-4-carboxamide is CCc1cc(C(=O)NC2CCCCC2)cc(F)n1.
What is the InChIKey of N-cyclohexyl-2-ethyl-6-fluoropyridine-4-carboxamide?
The InChIKey is DXXYWRNNKLCEFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2O/c1-2-11-8-10(9-13(15)16-11)14(18)17-12-6-4-3-5-7-12/h8-9,12H,2-7H2,1H3,(H,17,18).
What are the key properties of N-cyclohexyl-2-ethyl-6-fluoropyridine-4-carboxamide?
N-cyclohexyl-2-ethyl-6-fluoropyridine-4-carboxamide has a molecular weight of 250.32 g/mol, XLogP of 2.85, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-ethyl-6-fluoropyridine-4-carboxamide is sourced from PubChem (CID 123798509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).