N-[5-(2-methoxyethylamino)-2-pyridinyl]pyridine-3-carboxamide

C14H16N4O2 — CID 113025065

IUPACN-[5-(2-methoxyethylamino)-2-pyridinyl]pyridine-3-carboxamide
SMILESCOCCNc1ccc(NC(=O)c2cccnc2)nc1
InChIInChI=1S/C14H16N4O2/c1-20-8-7-16-12-4-5-13(17-10-12)18-14(19)11-3-2-6-15-9-11/h2-6,9-10,16H,7-8H2,1H3,(H,17,18,19)
InChIKeyIPRYVEROCSBLHB-UHFFFAOYSA-N
MW272.31 g/mol
LogP1.79
Rot. Bonds6

About N-[5-(2-methoxyethylamino)-2-pyridinyl]pyridine-3-carboxamide

N-[5-(2-methoxyethylamino)-2-pyridinyl]pyridine-3-carboxamide (PubChem CID 113025065) has the molecular formula C14H16N4O2 and a molecular weight of 272.31 g/mol. Its IUPAC name is N-[5-(2-methoxyethylamino)-2-pyridinyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[5-(2-methoxyethylamino)-2-pyridinyl]pyridine-3-carboxamide
PubChem CID113025065
Molecular FormulaC14H16N4O2
Molecular Weight272.31 g/mol
Exact Mass272.13
IUPAC NameN-[5-(2-methoxyethylamino)-2-pyridinyl]pyridine-3-carboxamide
SMILESCOCCNc1ccc(NC(=O)c2cccnc2)nc1
InChIInChI=1S/C14H16N4O2/c1-20-8-7-16-12-4-5-13(17-10-12)18-14(19)11-3-2-6-15-9-11/h2-6,9-10,16H,7-8H2,1H3,(H,17,18,19)
InChIKeyIPRYVEROCSBLHB-UHFFFAOYSA-N
XLogP1.79
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.31
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[5-[2-(dimethylamino)ethylamino]-2-pyridinyl]pyridine-3-carboxamide
CID 113025531
4-tert-butyl-N-[5-(2-methoxyethylamino)-2-pyridinyl]benzamide
CID 113025045
N-[6-(propanoylamino)-3-pyridinyl]pyridine-3-carboxamide
CID 43812722
N-[5-(butan-2-ylamino)-2-pyridinyl]pyridine-3-carboxamide
CID 113024266
N-[5-(4-ethoxyanilino)-2-pyridinyl]pyridine-3-carboxamide
CID 113034364
N-[5-(3-methoxyanilino)-2-pyridinyl]pyridine-3-carboxamide
CID 113034083
N-[5-(4-methylanilino)-2-pyridinyl]pyridine-3-carboxamide
CID 113031564
N-[6-(3-hydroxypropylamino)-3-pyridinyl]pyridine-3-carboxamide
CID 28901850
3-fluoro-N-[5-(3-methoxypropylamino)-2-pyridinyl]benzamide
CID 113025164
N-[5-(3-methylanilino)-2-pyridinyl]pyridine-3-carboxamide
CID 113031450
N-[6-(2-phenylethylamino)-3-pyridinyl]pyridine-3-carboxamide
CID 113013043
N-[5-(2-propan-2-yloxyanilino)-2-pyridinyl]pyridine-3-carboxamide
CID 113034520

Frequently Asked Questions

What is the IUPAC name of N-[5-(2-methoxyethylamino)-2-pyridinyl]pyridine-3-carboxamide?
The IUPAC name of N-[5-(2-methoxyethylamino)-2-pyridinyl]pyridine-3-carboxamide (CID 113025065) is N-[5-(2-methoxyethylamino)-2-pyridinyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[5-(2-methoxyethylamino)-2-pyridinyl]pyridine-3-carboxamide?
The canonical SMILES for N-[5-(2-methoxyethylamino)-2-pyridinyl]pyridine-3-carboxamide is COCCNc1ccc(NC(=O)c2cccnc2)nc1.
What is the InChIKey of N-[5-(2-methoxyethylamino)-2-pyridinyl]pyridine-3-carboxamide?
The InChIKey is IPRYVEROCSBLHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O2/c1-20-8-7-16-12-4-5-13(17-10-12)18-14(19)11-3-2-6-15-9-11/h2-6,9-10,16H,7-8H2,1H3,(H,17,18,19).
What are the key properties of N-[5-(2-methoxyethylamino)-2-pyridinyl]pyridine-3-carboxamide?
N-[5-(2-methoxyethylamino)-2-pyridinyl]pyridine-3-carboxamide has a molecular weight of 272.31 g/mol, XLogP of 1.79, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(2-methoxyethylamino)-2-pyridinyl]pyridine-3-carboxamide is sourced from PubChem (CID 113025065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).