2-[3-(dimethylamino)propylamino]-N-(5-methyl-1,2-oxazol-3-yl)pyridine-4-carboxamide

C15H21N5O2 — CID 109168464

IUPAC2-[3-(dimethylamino)propylamino]-N-(5-methyl-1,2-oxazol-3-yl)pyridine-4-carboxamide
SMILESCc1cc(NC(=O)c2ccnc(NCCCN(C)C)c2)no1
InChIInChI=1S/C15H21N5O2/c1-11-9-14(19-22-11)18-15(21)12-5-7-17-13(10-12)16-6-4-8-20(2)3/h5,7,9-10H,4,6,8H2,1-3H3,(H,16,17)(H,18,19,21)
InChIKeyLJRHWCNXCWJJJO-UHFFFAOYSA-N
MW303.37 g/mol
LogP1.99
Rot. Bonds7

About 2-[3-(dimethylamino)propylamino]-N-(5-methyl-1,2-oxazol-3-yl)pyridine-4-carboxamide

2-[3-(dimethylamino)propylamino]-N-(5-methyl-1,2-oxazol-3-yl)pyridine-4-carboxamide (PubChem CID 109168464) has the molecular formula C15H21N5O2 and a molecular weight of 303.37 g/mol. Its IUPAC name is 2-[3-(dimethylamino)propylamino]-N-(5-methyl-1,2-oxazol-3-yl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-[3-(dimethylamino)propylamino]-N-(5-methyl-1,2-oxazol-3-yl)pyridine-4-carboxamide
PubChem CID109168464
Molecular FormulaC15H21N5O2
Molecular Weight303.37 g/mol
Exact Mass303.17
IUPAC Name2-[3-(dimethylamino)propylamino]-N-(5-methyl-1,2-oxazol-3-yl)pyridine-4-carboxamide
SMILESCc1cc(NC(=O)c2ccnc(NCCCN(C)C)c2)no1
InChIInChI=1S/C15H21N5O2/c1-11-9-14(19-22-11)18-15(21)12-5-7-17-13(10-12)16-6-4-8-20(2)3/h5,7,9-10H,4,6,8H2,1-3H3,(H,16,17)(H,18,19,21)
InChIKeyLJRHWCNXCWJJJO-UHFFFAOYSA-N
XLogP1.99
TPSA83.29 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.37
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

2-(3-methoxypropylamino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-4-carboxamide
CID 109167318
2-(ethylamino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-4-carboxamide
CID 62167570
N-(4-acetamidophenyl)-2-[3-(dimethylamino)propylamino]pyridine-4-carboxamide
CID 109168419
2-[3-(dimethylamino)propylamino]-N-(5-methyl-1,2-oxazol-3-yl)pyrimidine-4-carboxamide
CID 109301852
2-[2-(dimethylamino)ethylamino]-N-[3-(dimethylamino)propyl]pyridine-4-carboxamide
CID 109167778
2-hydrazinyl-N-(5-methyl-1,2-oxazol-3-yl)pyridine-4-carboxamide
CID 62247564
N-butyl-2-[3-(dimethylamino)propylamino]pyridine-4-carboxamide
CID 109165408
2-[3-(dimethylamino)propylamino]-N-[2,6-di(propan-2-yl)phenyl]pyridine-4-carboxamide
CID 109168441
2-[3-(dimethylamino)propylamino]-N-prop-2-enylpyridine-4-carboxamide
CID 109165269
N-[3-(dimethylamino)propyl]-2-(propylamino)pyridine-4-carboxamide
CID 55042326
2-[3-(dimethylamino)propylamino]-N-(3-methoxyphenyl)pyridine-4-carboxamide
CID 109168403
2-[3-(dimethylamino)propylamino]-N-[4-(4-methylpiperazin-1-yl)phenyl]pyridine-4-carboxamide
CID 109168430

Frequently Asked Questions

What is the IUPAC name of 2-[3-(dimethylamino)propylamino]-N-(5-methyl-1,2-oxazol-3-yl)pyridine-4-carboxamide?
The IUPAC name of 2-[3-(dimethylamino)propylamino]-N-(5-methyl-1,2-oxazol-3-yl)pyridine-4-carboxamide (CID 109168464) is 2-[3-(dimethylamino)propylamino]-N-(5-methyl-1,2-oxazol-3-yl)pyridine-4-carboxamide.
What is the SMILES notation for 2-[3-(dimethylamino)propylamino]-N-(5-methyl-1,2-oxazol-3-yl)pyridine-4-carboxamide?
The canonical SMILES for 2-[3-(dimethylamino)propylamino]-N-(5-methyl-1,2-oxazol-3-yl)pyridine-4-carboxamide is Cc1cc(NC(=O)c2ccnc(NCCCN(C)C)c2)no1.
What is the InChIKey of 2-[3-(dimethylamino)propylamino]-N-(5-methyl-1,2-oxazol-3-yl)pyridine-4-carboxamide?
The InChIKey is LJRHWCNXCWJJJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O2/c1-11-9-14(19-22-11)18-15(21)12-5-7-17-13(10-12)16-6-4-8-20(2)3/h5,7,9-10H,4,6,8H2,1-3H3,(H,16,17)(H,18,19,21).
What are the key properties of 2-[3-(dimethylamino)propylamino]-N-(5-methyl-1,2-oxazol-3-yl)pyridine-4-carboxamide?
2-[3-(dimethylamino)propylamino]-N-(5-methyl-1,2-oxazol-3-yl)pyridine-4-carboxamide has a molecular weight of 303.37 g/mol, XLogP of 1.99, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(dimethylamino)propylamino]-N-(5-methyl-1,2-oxazol-3-yl)pyridine-4-carboxamide is sourced from PubChem (CID 109168464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).