6-methyl-N-(1-methylpyrrolidin-3-yl)-4-(propylamino)pyridine-3-carboxamide

C15H24N4O — CID 81240249

IUPAC6-methyl-N-(1-methylpyrrolidin-3-yl)-4-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1cc(C)ncc1C(=O)NC1CCN(C)C1
InChIInChI=1S/C15H24N4O/c1-4-6-16-14-8-11(2)17-9-13(14)15(20)18-12-5-7-19(3)10-12/h8-9,12H,4-7,10H2,1-3H3,(H,16,17)(H,18,20)
InChIKeyTUFJJWMEIIEOOM-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.65
Rot. Bonds5

About 6-methyl-N-(1-methylpyrrolidin-3-yl)-4-(propylamino)pyridine-3-carboxamide

6-methyl-N-(1-methylpyrrolidin-3-yl)-4-(propylamino)pyridine-3-carboxamide (PubChem CID 81240249) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is 6-methyl-N-(1-methylpyrrolidin-3-yl)-4-(propylamino)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-methyl-N-(1-methylpyrrolidin-3-yl)-4-(propylamino)pyridine-3-carboxamide
PubChem CID81240249
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name6-methyl-N-(1-methylpyrrolidin-3-yl)-4-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1cc(C)ncc1C(=O)NC1CCN(C)C1
InChIInChI=1S/C15H24N4O/c1-4-6-16-14-8-11(2)17-9-13(14)15(20)18-12-5-7-19(3)10-12/h8-9,12H,4-7,10H2,1-3H3,(H,16,17)(H,18,20)
InChIKeyTUFJJWMEIIEOOM-UHFFFAOYSA-N
XLogP1.65
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-(1-methylpyrrolidin-3-yl)-4-(propylamino)pyridine-3-carboxamide?
The IUPAC name of 6-methyl-N-(1-methylpyrrolidin-3-yl)-4-(propylamino)pyridine-3-carboxamide (CID 81240249) is 6-methyl-N-(1-methylpyrrolidin-3-yl)-4-(propylamino)pyridine-3-carboxamide.
What is the SMILES notation for 6-methyl-N-(1-methylpyrrolidin-3-yl)-4-(propylamino)pyridine-3-carboxamide?
The canonical SMILES for 6-methyl-N-(1-methylpyrrolidin-3-yl)-4-(propylamino)pyridine-3-carboxamide is CCCNc1cc(C)ncc1C(=O)NC1CCN(C)C1.
What is the InChIKey of 6-methyl-N-(1-methylpyrrolidin-3-yl)-4-(propylamino)pyridine-3-carboxamide?
The InChIKey is TUFJJWMEIIEOOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-4-6-16-14-8-11(2)17-9-13(14)15(20)18-12-5-7-19(3)10-12/h8-9,12H,4-7,10H2,1-3H3,(H,16,17)(H,18,20).
What are the key properties of 6-methyl-N-(1-methylpyrrolidin-3-yl)-4-(propylamino)pyridine-3-carboxamide?
6-methyl-N-(1-methylpyrrolidin-3-yl)-4-(propylamino)pyridine-3-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 1.65, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-(1-methylpyrrolidin-3-yl)-4-(propylamino)pyridine-3-carboxamide is sourced from PubChem (CID 81240249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).