N-[2-(dimethylamino)ethyl]-2-fluoropyridine-4-carboxamide

C10H14FN3O — CID 61294521

IUPACN-[2-(dimethylamino)ethyl]-2-fluoropyridine-4-carboxamide
SMILESCN(C)CCNC(=O)c1ccnc(F)c1
InChIInChI=1S/C10H14FN3O/c1-14(2)6-5-13-10(15)8-3-4-12-9(11)7-8/h3-4,7H,5-6H2,1-2H3,(H,13,15)
InChIKeyMJYKVRWBOVSROY-UHFFFAOYSA-N
MW211.24 g/mol
LogP0.51
Rot. Bonds4

About N-[2-(dimethylamino)ethyl]-2-fluoropyridine-4-carboxamide

N-[2-(dimethylamino)ethyl]-2-fluoropyridine-4-carboxamide (PubChem CID 61294521) has the molecular formula C10H14FN3O and a molecular weight of 211.24 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-2-fluoropyridine-4-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-2-fluoropyridine-4-carboxamide
PubChem CID61294521
Molecular FormulaC10H14FN3O
Molecular Weight211.24 g/mol
Exact Mass211.11
IUPAC NameN-[2-(dimethylamino)ethyl]-2-fluoropyridine-4-carboxamide
SMILESCN(C)CCNC(=O)c1ccnc(F)c1
InChIInChI=1S/C10H14FN3O/c1-14(2)6-5-13-10(15)8-3-4-12-9(11)7-8/h3-4,7H,5-6H2,1-2H3,(H,13,15)
InChIKeyMJYKVRWBOVSROY-UHFFFAOYSA-N
XLogP0.51
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.24
LogP ≤ 50.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-fluoro-N-[2-[methyl(propan-2-yl)amino]ethyl]pyridine-4-carboxamide
CID 62641304
2-(dimethylamino)-N-[2-(dimethylamino)ethyl]pyridine-4-carboxamide
CID 84574435
2-(acetamidomethyl)-N-[2-(dimethylamino)ethyl]pyridine-4-carboxamide
CID 112520173
N-[2-(dimethylamino)ethyl]-2-[(dimethylcarbamoylamino)methyl]pyridine-4-carboxamide
CID 112520177
N-[2-[cyclopropyl(ethyl)amino]ethyl]-2-fluoropyridine-4-carboxamide
CID 113229925
N-[3-(diethylamino)-3-oxopropyl]-2-fluoropyridine-4-carboxamide
CID 61292893
N-[2-(dimethylamino)ethyl]-2-fluoro-N-methylpyridine-4-carboxamide
CID 63693462
N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-fluoropyridine-4-carboxamide
CID 61293798
2-fluoro-N-(4-methylpentyl)pyridine-4-carboxamide
CID 61293855
N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-fluoropyridine-4-carboxamide
CID 103840043
4-N-[2-(dimethylamino)ethyl]-2-N-[(2-fluorophenyl)methyl]pyridine-2,4-dicarboxamide
CID 109083406
N-[2-(dimethylamino)ethyl]-2-[(2-fluorophenyl)methylamino]pyridine-4-carboxamide
CID 109167657

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-2-fluoropyridine-4-carboxamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-2-fluoropyridine-4-carboxamide (CID 61294521) is N-[2-(dimethylamino)ethyl]-2-fluoropyridine-4-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-2-fluoropyridine-4-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-2-fluoropyridine-4-carboxamide is CN(C)CCNC(=O)c1ccnc(F)c1.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-2-fluoropyridine-4-carboxamide?
The InChIKey is MJYKVRWBOVSROY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FN3O/c1-14(2)6-5-13-10(15)8-3-4-12-9(11)7-8/h3-4,7H,5-6H2,1-2H3,(H,13,15).
What are the key properties of N-[2-(dimethylamino)ethyl]-2-fluoropyridine-4-carboxamide?
N-[2-(dimethylamino)ethyl]-2-fluoropyridine-4-carboxamide has a molecular weight of 211.24 g/mol, XLogP of 0.51, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-2-fluoropyridine-4-carboxamide is sourced from PubChem (CID 61294521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).