N-ethyl-6-[(7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)amino]pyridine-3-carboxamide

C18H20FN3O — CID 133446444

IUPACN-ethyl-6-[(7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)amino]pyridine-3-carboxamide
SMILESCCNC(=O)c1ccc(NC2CCCc3ccc(F)cc32)nc1
InChIInChI=1S/C18H20FN3O/c1-2-20-18(23)13-7-9-17(21-11-13)22-16-5-3-4-12-6-8-14(19)10-15(12)16/h6-11,16H,2-5H2,1H3,(H,20,23)(H,21,22)
InChIKeyGRNSVBCKLGYBQV-UHFFFAOYSA-N
MW313.38 g/mol
LogP3.46
Rot. Bonds4

About N-ethyl-6-[(7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)amino]pyridine-3-carboxamide

N-ethyl-6-[(7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)amino]pyridine-3-carboxamide (PubChem CID 133446444) has the molecular formula C18H20FN3O and a molecular weight of 313.38 g/mol. Its IUPAC name is N-ethyl-6-[(7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)amino]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-6-[(7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)amino]pyridine-3-carboxamide
PubChem CID133446444
Molecular FormulaC18H20FN3O
Molecular Weight313.38 g/mol
Exact Mass313.16
IUPAC NameN-ethyl-6-[(7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)amino]pyridine-3-carboxamide
SMILESCCNC(=O)c1ccc(NC2CCCc3ccc(F)cc32)nc1
InChIInChI=1S/C18H20FN3O/c1-2-20-18(23)13-7-9-17(21-11-13)22-16-5-3-4-12-6-8-14(19)10-15(12)16/h6-11,16H,2-5H2,1H3,(H,20,23)(H,21,22)
InChIKeyGRNSVBCKLGYBQV-UHFFFAOYSA-N
XLogP3.46
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.38
LogP ≤ 53.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-4-[[(1R)-7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl]oxy]benzamide
CID 97099967
N-(7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)-5-piperidin-1-ylsulfonylpyridin-2-amine
CID 133446329
5-fluoro-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyridin-2-amine
CID 62304263
N-[(1R)-7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl]-4-(1,2,4-triazol-4-yl)benzamide
CID 97062336
5-bromo-N-(7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)pyrimidin-2-amine
CID 133446372
N-ethyl-6-(6-fluoro-3,4-dihydro-1H-isoquinolin-2-yl)pyridine-3-carboxamide
CID 133422541
4-[[[(1S)-7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl]amino]methyl]benzoic acid
CID 122033747
6-chloro-3-[(7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)amino]pyridazine-4-carboxamide
CID 133446450
N-ethyl-6-hydrazinylpyridine-3-carboxamide
CID 20734038
3-[[(1S)-7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl]carbamoylamino]propanoic acid
CID 122012602
1-[(1R)-7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl]-3-[(1-methylsulfinylcyclobutyl)methyl]urea
CID 122150033
N-ethyl-6-[(2,2,5,5-tetramethyloxolan-3-yl)amino]pyridine-3-carboxamide
CID 133439056

Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-[(7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)amino]pyridine-3-carboxamide?
The IUPAC name of N-ethyl-6-[(7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)amino]pyridine-3-carboxamide (CID 133446444) is N-ethyl-6-[(7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)amino]pyridine-3-carboxamide.
What is the SMILES notation for N-ethyl-6-[(7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)amino]pyridine-3-carboxamide?
The canonical SMILES for N-ethyl-6-[(7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)amino]pyridine-3-carboxamide is CCNC(=O)c1ccc(NC2CCCc3ccc(F)cc32)nc1.
What is the InChIKey of N-ethyl-6-[(7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)amino]pyridine-3-carboxamide?
The InChIKey is GRNSVBCKLGYBQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20FN3O/c1-2-20-18(23)13-7-9-17(21-11-13)22-16-5-3-4-12-6-8-14(19)10-15(12)16/h6-11,16H,2-5H2,1H3,(H,20,23)(H,21,22).
What are the key properties of N-ethyl-6-[(7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)amino]pyridine-3-carboxamide?
N-ethyl-6-[(7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)amino]pyridine-3-carboxamide has a molecular weight of 313.38 g/mol, XLogP of 3.46, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-[(7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)amino]pyridine-3-carboxamide is sourced from PubChem (CID 133446444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).