2-amino-N-(1,3-dimethylpiperidin-4-yl)-3-fluoropyridine-4-carboxamide

C13H19FN4O — CID 105387679

IUPAC2-amino-N-(1,3-dimethylpiperidin-4-yl)-3-fluoropyridine-4-carboxamide
SMILESCC1CN(C)CCC1NC(=O)c1ccnc(N)c1F
InChIInChI=1S/C13H19FN4O/c1-8-7-18(2)6-4-10(8)17-13(19)9-3-5-16-12(15)11(9)14/h3,5,8,10H,4,6-7H2,1-2H3,(H2,15,16)(H,17,19)
InChIKeyCQPXHUCWVHCOJB-UHFFFAOYSA-N
MW266.32 g/mol
LogP0.87
Rot. Bonds2

About 2-amino-N-(1,3-dimethylpiperidin-4-yl)-3-fluoropyridine-4-carboxamide

2-amino-N-(1,3-dimethylpiperidin-4-yl)-3-fluoropyridine-4-carboxamide (PubChem CID 105387679) has the molecular formula C13H19FN4O and a molecular weight of 266.32 g/mol. Its IUPAC name is 2-amino-N-(1,3-dimethylpiperidin-4-yl)-3-fluoropyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-(1,3-dimethylpiperidin-4-yl)-3-fluoropyridine-4-carboxamide
PubChem CID105387679
Molecular FormulaC13H19FN4O
Molecular Weight266.32 g/mol
Exact Mass266.15
IUPAC Name2-amino-N-(1,3-dimethylpiperidin-4-yl)-3-fluoropyridine-4-carboxamide
SMILESCC1CN(C)CCC1NC(=O)c1ccnc(N)c1F
InChIInChI=1S/C13H19FN4O/c1-8-7-18(2)6-4-10(8)17-13(19)9-3-5-16-12(15)11(9)14/h3,5,8,10H,4,6-7H2,1-2H3,(H2,15,16)(H,17,19)
InChIKeyCQPXHUCWVHCOJB-UHFFFAOYSA-N
XLogP0.87
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.32
LogP ≤ 50.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-5-bromo-N-(1,3-dimethylpiperidin-4-yl)pyridine-3-carboxamide
CID 114505946
2-amino-3-fluoro-N-[2-(1-methylpiperidin-4-yl)ethyl]pyridine-4-carboxamide
CID 105387682
3-amino-N-(1,3-dimethylpiperidin-4-yl)-2,6-difluorobenzamide
CID 114502840
5-amino-N-(1,3-dimethylpiperidin-4-yl)-2-methylpyridine-3-carboxamide
CID 114502792
2-amino-N-cyclooctyl-3-fluoropyridine-4-carboxamide
CID 105384104
5-amino-N-(1,3-dimethylpiperidin-4-yl)-2,4-dimethylbenzamide
CID 102706008
N-(1,3-dimethylpiperidin-4-yl)-3-fluoro-2-(methylamino)benzamide
CID 114505924
N-(1,3-dimethylpiperidin-4-yl)-2,3-dihydroxybenzamide
CID 114504406
2-amino-N-(2,6-dimethylpiperidin-1-yl)-3-fluoropyridine-4-carboxamide
CID 105387166
3-amino-5-bromo-N-(1,3-dimethylpiperidin-4-yl)-2-methylbenzamide
CID 107873193
2-amino-N-(cyclopropylmethyl)-3-fluoropyridine-4-carboxamide
CID 105384388
N-(1,3-dimethylpiperidin-4-yl)-3,5-difluoro-4-hydrazinylbenzamide
CID 114505992

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(1,3-dimethylpiperidin-4-yl)-3-fluoropyridine-4-carboxamide?
The IUPAC name of 2-amino-N-(1,3-dimethylpiperidin-4-yl)-3-fluoropyridine-4-carboxamide (CID 105387679) is 2-amino-N-(1,3-dimethylpiperidin-4-yl)-3-fluoropyridine-4-carboxamide.
What is the SMILES notation for 2-amino-N-(1,3-dimethylpiperidin-4-yl)-3-fluoropyridine-4-carboxamide?
The canonical SMILES for 2-amino-N-(1,3-dimethylpiperidin-4-yl)-3-fluoropyridine-4-carboxamide is CC1CN(C)CCC1NC(=O)c1ccnc(N)c1F.
What is the InChIKey of 2-amino-N-(1,3-dimethylpiperidin-4-yl)-3-fluoropyridine-4-carboxamide?
The InChIKey is CQPXHUCWVHCOJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19FN4O/c1-8-7-18(2)6-4-10(8)17-13(19)9-3-5-16-12(15)11(9)14/h3,5,8,10H,4,6-7H2,1-2H3,(H2,15,16)(H,17,19).
What are the key properties of 2-amino-N-(1,3-dimethylpiperidin-4-yl)-3-fluoropyridine-4-carboxamide?
2-amino-N-(1,3-dimethylpiperidin-4-yl)-3-fluoropyridine-4-carboxamide has a molecular weight of 266.32 g/mol, XLogP of 0.87, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(1,3-dimethylpiperidin-4-yl)-3-fluoropyridine-4-carboxamide is sourced from PubChem (CID 105387679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).