N-(3-fluoro-4-pyridinyl)-2-(methylamino)-6-propylpyridine-4-carboxamide

C15H17FN4O — CID 107595546

IUPACN-(3-fluoro-4-pyridinyl)-2-(methylamino)-6-propylpyridine-4-carboxamide
SMILESCCCc1cc(C(=O)Nc2ccncc2F)cc(NC)n1
InChIInChI=1S/C15H17FN4O/c1-3-4-11-7-10(8-14(17-2)19-11)15(21)20-13-5-6-18-9-12(13)16/h5-9H,3-4H2,1-2H3,(H,17,19)(H,18,20,21)
InChIKeyVYXUUXVVBQYBBC-UHFFFAOYSA-N
MW288.33 g/mol
LogP2.86
Rot. Bonds5

About N-(3-fluoro-4-pyridinyl)-2-(methylamino)-6-propylpyridine-4-carboxamide

N-(3-fluoro-4-pyridinyl)-2-(methylamino)-6-propylpyridine-4-carboxamide (PubChem CID 107595546) has the molecular formula C15H17FN4O and a molecular weight of 288.33 g/mol. Its IUPAC name is N-(3-fluoro-4-pyridinyl)-2-(methylamino)-6-propylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-(3-fluoro-4-pyridinyl)-2-(methylamino)-6-propylpyridine-4-carboxamide
PubChem CID107595546
Molecular FormulaC15H17FN4O
Molecular Weight288.33 g/mol
Exact Mass288.14
IUPAC NameN-(3-fluoro-4-pyridinyl)-2-(methylamino)-6-propylpyridine-4-carboxamide
SMILESCCCc1cc(C(=O)Nc2ccncc2F)cc(NC)n1
InChIInChI=1S/C15H17FN4O/c1-3-4-11-7-10(8-14(17-2)19-11)15(21)20-13-5-6-18-9-12(13)16/h5-9H,3-4H2,1-2H3,(H,17,19)(H,18,20,21)
InChIKeyVYXUUXVVBQYBBC-UHFFFAOYSA-N
XLogP2.86
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.33
LogP ≤ 52.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(ethylamino)-N-(3-fluoro-4-pyridinyl)-6-methylpyridine-4-carboxamide
CID 107595487
2-chloro-6-(ethylamino)-N-(3-fluoro-4-pyridinyl)pyridine-4-carboxamide
CID 107595523
2,6-dichloro-N-(3-fluoro-4-pyridinyl)pyridine-4-carboxamide
CID 113342448
N-(3-fluoro-4-pyridinyl)-4-(methylamino)pyridine-3-carboxamide
CID 107595502
2-(methylamino)-N-(3-methylpentan-3-yl)-6-propylpyridine-4-carboxamide
CID 106331240
3-bromo-5-chloro-N-(3-fluoro-4-pyridinyl)benzamide
CID 113343068
5-chloro-N-(3-fluoro-4-pyridinyl)-6-(methylamino)pyridine-3-carboxamide
CID 107595440
4-(bromomethyl)-N-(3-fluoro-4-pyridinyl)benzamide
CID 107594820
N-(3-fluoro-4-pyridinyl)-2-methyl-1,3-benzothiazole-6-carboxamide
CID 57412037
4-bromo-3-fluoro-N-(3-fluoro-4-pyridinyl)benzamide
CID 103871197
4-acetyl-N-(3-fluoro-4-pyridinyl)thiophene-2-carboxamide
CID 84595007
N-(3-fluoro-4-pyridinyl)-5-(propylamino)pyridine-2-carboxamide
CID 107595450

Frequently Asked Questions

What is the IUPAC name of N-(3-fluoro-4-pyridinyl)-2-(methylamino)-6-propylpyridine-4-carboxamide?
The IUPAC name of N-(3-fluoro-4-pyridinyl)-2-(methylamino)-6-propylpyridine-4-carboxamide (CID 107595546) is N-(3-fluoro-4-pyridinyl)-2-(methylamino)-6-propylpyridine-4-carboxamide.
What is the SMILES notation for N-(3-fluoro-4-pyridinyl)-2-(methylamino)-6-propylpyridine-4-carboxamide?
The canonical SMILES for N-(3-fluoro-4-pyridinyl)-2-(methylamino)-6-propylpyridine-4-carboxamide is CCCc1cc(C(=O)Nc2ccncc2F)cc(NC)n1.
What is the InChIKey of N-(3-fluoro-4-pyridinyl)-2-(methylamino)-6-propylpyridine-4-carboxamide?
The InChIKey is VYXUUXVVBQYBBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN4O/c1-3-4-11-7-10(8-14(17-2)19-11)15(21)20-13-5-6-18-9-12(13)16/h5-9H,3-4H2,1-2H3,(H,17,19)(H,18,20,21).
What are the key properties of N-(3-fluoro-4-pyridinyl)-2-(methylamino)-6-propylpyridine-4-carboxamide?
N-(3-fluoro-4-pyridinyl)-2-(methylamino)-6-propylpyridine-4-carboxamide has a molecular weight of 288.33 g/mol, XLogP of 2.86, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluoro-4-pyridinyl)-2-(methylamino)-6-propylpyridine-4-carboxamide is sourced from PubChem (CID 107595546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).