N-[6-(2-methylpropanoylamino)-3-pyridinyl]pyridine-2-carboxamide

C15H16N4O2 — CID 649501

IUPACN-[6-(2-methylpropanoylamino)-3-pyridinyl]pyridine-2-carboxamide
SMILESCC(C)C(=O)Nc1ccc(NC(=O)c2ccccn2)cn1
InChIInChI=1S/C15H16N4O2/c1-10(2)14(20)19-13-7-6-11(9-17-13)18-15(21)12-5-3-4-8-16-12/h3-10H,1-2H3,(H,18,21)(H,17,19,20)
InChIKeySSTQCQAGVYKASL-UHFFFAOYSA-N
MW284.32 g/mol
LogP2.32
Rot. Bonds4

About N-[6-(2-methylpropanoylamino)-3-pyridinyl]pyridine-2-carboxamide

N-[6-(2-methylpropanoylamino)-3-pyridinyl]pyridine-2-carboxamide (PubChem CID 649501) has the molecular formula C15H16N4O2 and a molecular weight of 284.32 g/mol. Its IUPAC name is N-[6-(2-methylpropanoylamino)-3-pyridinyl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[6-(2-methylpropanoylamino)-3-pyridinyl]pyridine-2-carboxamide
PubChem CID649501
Molecular FormulaC15H16N4O2
Molecular Weight284.32 g/mol
Exact Mass284.13
IUPAC NameN-[6-(2-methylpropanoylamino)-3-pyridinyl]pyridine-2-carboxamide
SMILESCC(C)C(=O)Nc1ccc(NC(=O)c2ccccn2)cn1
InChIInChI=1S/C15H16N4O2/c1-10(2)14(20)19-13-7-6-11(9-17-13)18-15(21)12-5-3-4-8-16-12/h3-10H,1-2H3,(H,18,21)(H,17,19,20)
InChIKeySSTQCQAGVYKASL-UHFFFAOYSA-N
XLogP2.32
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[6-(2-methylpropanoylamino)-3-pyridinyl]pyridine-2-carboxamide?
The IUPAC name of N-[6-(2-methylpropanoylamino)-3-pyridinyl]pyridine-2-carboxamide (CID 649501) is N-[6-(2-methylpropanoylamino)-3-pyridinyl]pyridine-2-carboxamide.
What is the SMILES notation for N-[6-(2-methylpropanoylamino)-3-pyridinyl]pyridine-2-carboxamide?
The canonical SMILES for N-[6-(2-methylpropanoylamino)-3-pyridinyl]pyridine-2-carboxamide is CC(C)C(=O)Nc1ccc(NC(=O)c2ccccn2)cn1.
What is the InChIKey of N-[6-(2-methylpropanoylamino)-3-pyridinyl]pyridine-2-carboxamide?
The InChIKey is SSTQCQAGVYKASL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O2/c1-10(2)14(20)19-13-7-6-11(9-17-13)18-15(21)12-5-3-4-8-16-12/h3-10H,1-2H3,(H,18,21)(H,17,19,20).
What are the key properties of N-[6-(2-methylpropanoylamino)-3-pyridinyl]pyridine-2-carboxamide?
N-[6-(2-methylpropanoylamino)-3-pyridinyl]pyridine-2-carboxamide has a molecular weight of 284.32 g/mol, XLogP of 2.32, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(2-methylpropanoylamino)-3-pyridinyl]pyridine-2-carboxamide is sourced from PubChem (CID 649501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).