6-methyl-2-(1-piperidin-3-ylethylamino)pyridine-3-carboxamide

C14H22N4O — CID 62047261

IUPAC6-methyl-2-(1-piperidin-3-ylethylamino)pyridine-3-carboxamide
SMILESCc1ccc(C(N)=O)c(NC(C)C2CCCNC2)n1
InChIInChI=1S/C14H22N4O/c1-9-5-6-12(13(15)19)14(17-9)18-10(2)11-4-3-7-16-8-11/h5-6,10-11,16H,3-4,7-8H2,1-2H3,(H2,15,19)(H,17,18)
InChIKeyACATWTDQMIKIRM-UHFFFAOYSA-N
MW262.36 g/mol
LogP1.29
Rot. Bonds4

About 6-methyl-2-(1-piperidin-3-ylethylamino)pyridine-3-carboxamide

6-methyl-2-(1-piperidin-3-ylethylamino)pyridine-3-carboxamide (PubChem CID 62047261) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is 6-methyl-2-(1-piperidin-3-ylethylamino)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-methyl-2-(1-piperidin-3-ylethylamino)pyridine-3-carboxamide
PubChem CID62047261
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name6-methyl-2-(1-piperidin-3-ylethylamino)pyridine-3-carboxamide
SMILESCc1ccc(C(N)=O)c(NC(C)C2CCCNC2)n1
InChIInChI=1S/C14H22N4O/c1-9-5-6-12(13(15)19)14(17-9)18-10(2)11-4-3-7-16-8-11/h5-6,10-11,16H,3-4,7-8H2,1-2H3,(H2,15,19)(H,17,18)
InChIKeyACATWTDQMIKIRM-UHFFFAOYSA-N
XLogP1.29
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 51.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-(1-piperidin-3-ylethylamino)pyridine-3-carboxamide?
The IUPAC name of 6-methyl-2-(1-piperidin-3-ylethylamino)pyridine-3-carboxamide (CID 62047261) is 6-methyl-2-(1-piperidin-3-ylethylamino)pyridine-3-carboxamide.
What is the SMILES notation for 6-methyl-2-(1-piperidin-3-ylethylamino)pyridine-3-carboxamide?
The canonical SMILES for 6-methyl-2-(1-piperidin-3-ylethylamino)pyridine-3-carboxamide is Cc1ccc(C(N)=O)c(NC(C)C2CCCNC2)n1.
What is the InChIKey of 6-methyl-2-(1-piperidin-3-ylethylamino)pyridine-3-carboxamide?
The InChIKey is ACATWTDQMIKIRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-9-5-6-12(13(15)19)14(17-9)18-10(2)11-4-3-7-16-8-11/h5-6,10-11,16H,3-4,7-8H2,1-2H3,(H2,15,19)(H,17,18).
What are the key properties of 6-methyl-2-(1-piperidin-3-ylethylamino)pyridine-3-carboxamide?
6-methyl-2-(1-piperidin-3-ylethylamino)pyridine-3-carboxamide has a molecular weight of 262.36 g/mol, XLogP of 1.29, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-(1-piperidin-3-ylethylamino)pyridine-3-carboxamide is sourced from PubChem (CID 62047261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).