N-[6-(propanoylamino)-3-pyridinyl]pyridine-3-carboxamide

C14H14N4O2 — CID 43812722

IUPACN-[6-(propanoylamino)-3-pyridinyl]pyridine-3-carboxamide
SMILESCCC(=O)Nc1ccc(NC(=O)c2cccnc2)cn1
InChIInChI=1S/C14H14N4O2/c1-2-13(19)18-12-6-5-11(9-16-12)17-14(20)10-4-3-7-15-8-10/h3-9H,2H2,1H3,(H,17,20)(H,16,18,19)
InChIKeyAYFXUKNDJKIFNP-UHFFFAOYSA-N
MW270.29 g/mol
LogP2.08
Rot. Bonds4

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

N-[6-(propanoylamino)-3-pyridinyl]pyridine-3-carboxamide (PubChem CID 43812722) has the molecular formula C14H14N4O2 and a molecular weight of 270.29 g/mol. Its IUPAC name is N-[6-(propanoylamino)-3-pyridinyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[6-(propanoylamino)-3-pyridinyl]pyridine-3-carboxamide
PubChem CID43812722
Molecular FormulaC14H14N4O2
Molecular Weight270.29 g/mol
Exact Mass270.11
IUPAC NameN-[6-(propanoylamino)-3-pyridinyl]pyridine-3-carboxamide
SMILESCCC(=O)Nc1ccc(NC(=O)c2cccnc2)cn1
InChIInChI=1S/C14H14N4O2/c1-2-13(19)18-12-6-5-11(9-16-12)17-14(20)10-4-3-7-15-8-10/h3-9H,2H2,1H3,(H,17,20)(H,16,18,19)
InChIKeyAYFXUKNDJKIFNP-UHFFFAOYSA-N
XLogP2.08
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[5-(butan-2-ylamino)-2-pyridinyl]pyridine-3-carboxamide
CID 113024266
N-[6-[4-(diethylamino)anilino]-3-pyridinyl]pyridine-3-carboxamide
CID 113020962
N-[6-(3-hydroxypropylamino)-3-pyridinyl]pyridine-3-carboxamide
CID 28901850
N-[5-(2-methoxyethylamino)-2-pyridinyl]pyridine-3-carboxamide
CID 113025065
N-[5-(4-ethoxyanilino)-2-pyridinyl]pyridine-3-carboxamide
CID 113034364
N-[5-(4-methylanilino)-2-pyridinyl]pyridine-3-carboxamide
CID 113031564
N-[5-[2-(dimethylamino)ethylamino]-2-pyridinyl]pyridine-3-carboxamide
CID 113025531
N-[6-(2-phenylethylamino)-3-pyridinyl]pyridine-3-carboxamide
CID 113013043
N-(4-acetamidophenyl)pyridine-3-carboxamide
CID 766053
N-[6-(2,4-dimethylanilino)-3-pyridinyl]pyridine-3-carboxamide
CID 113016789
2,2-dimethyl-N-[6-(propanoylamino)-3-pyridinyl]propanamide
CID 1452729
N-[4-[[2-(2-ethoxyphenoxy)acetyl]amino]phenyl]pyridine-3-carboxamide
CID 108925024

Frequently Asked Questions

What is the IUPAC name of N-[6-(propanoylamino)-3-pyridinyl]pyridine-3-carboxamide?
The IUPAC name of N-[6-(propanoylamino)-3-pyridinyl]pyridine-3-carboxamide (CID 43812722) is N-[6-(propanoylamino)-3-pyridinyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[6-(propanoylamino)-3-pyridinyl]pyridine-3-carboxamide?
The canonical SMILES for N-[6-(propanoylamino)-3-pyridinyl]pyridine-3-carboxamide is CCC(=O)Nc1ccc(NC(=O)c2cccnc2)cn1.
What is the InChIKey of N-[6-(propanoylamino)-3-pyridinyl]pyridine-3-carboxamide?
The InChIKey is AYFXUKNDJKIFNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O2/c1-2-13(19)18-12-6-5-11(9-16-12)17-14(20)10-4-3-7-15-8-10/h3-9H,2H2,1H3,(H,17,20)(H,16,18,19).
What are the key properties of N-[6-(propanoylamino)-3-pyridinyl]pyridine-3-carboxamide?
N-[6-(propanoylamino)-3-pyridinyl]pyridine-3-carboxamide has a molecular weight of 270.29 g/mol, XLogP of 2.08, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(propanoylamino)-3-pyridinyl]pyridine-3-carboxamide is sourced from PubChem (CID 43812722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).