N-[(2,4-dimethyl-1,3-oxazol-5-yl)methyl]-6-propan-2-ylpyridine-3-carboxamide

C15H19N3O2 — CID 136545101

IUPACN-[(2,4-dimethyl-1,3-oxazol-5-yl)methyl]-6-propan-2-ylpyridine-3-carboxamide
SMILESCc1nc(C)c(CNC(=O)c2ccc(C(C)C)nc2)o1
InChIInChI=1S/C15H19N3O2/c1-9(2)13-6-5-12(7-16-13)15(19)17-8-14-10(3)18-11(4)20-14/h5-7,9H,8H2,1-4H3,(H,17,19)
InChIKeyOYPZOBXJDPFHCP-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.74
Rot. Bonds4

About N-[(2,4-dimethyl-1,3-oxazol-5-yl)methyl]-6-propan-2-ylpyridine-3-carboxamide

N-[(2,4-dimethyl-1,3-oxazol-5-yl)methyl]-6-propan-2-ylpyridine-3-carboxamide (PubChem CID 136545101) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is N-[(2,4-dimethyl-1,3-oxazol-5-yl)methyl]-6-propan-2-ylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(2,4-dimethyl-1,3-oxazol-5-yl)methyl]-6-propan-2-ylpyridine-3-carboxamide
PubChem CID136545101
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC NameN-[(2,4-dimethyl-1,3-oxazol-5-yl)methyl]-6-propan-2-ylpyridine-3-carboxamide
SMILESCc1nc(C)c(CNC(=O)c2ccc(C(C)C)nc2)o1
InChIInChI=1S/C15H19N3O2/c1-9(2)13-6-5-12(7-16-13)15(19)17-8-14-10(3)18-11(4)20-14/h5-7,9H,8H2,1-4H3,(H,17,19)
InChIKeyOYPZOBXJDPFHCP-UHFFFAOYSA-N
XLogP2.74
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(2,4-dimethyl-1,3-oxazol-5-yl)methyl]-6-propan-2-ylpyridine-3-carboxamide?
The IUPAC name of N-[(2,4-dimethyl-1,3-oxazol-5-yl)methyl]-6-propan-2-ylpyridine-3-carboxamide (CID 136545101) is N-[(2,4-dimethyl-1,3-oxazol-5-yl)methyl]-6-propan-2-ylpyridine-3-carboxamide.
What is the SMILES notation for N-[(2,4-dimethyl-1,3-oxazol-5-yl)methyl]-6-propan-2-ylpyridine-3-carboxamide?
The canonical SMILES for N-[(2,4-dimethyl-1,3-oxazol-5-yl)methyl]-6-propan-2-ylpyridine-3-carboxamide is Cc1nc(C)c(CNC(=O)c2ccc(C(C)C)nc2)o1.
What is the InChIKey of N-[(2,4-dimethyl-1,3-oxazol-5-yl)methyl]-6-propan-2-ylpyridine-3-carboxamide?
The InChIKey is OYPZOBXJDPFHCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-9(2)13-6-5-12(7-16-13)15(19)17-8-14-10(3)18-11(4)20-14/h5-7,9H,8H2,1-4H3,(H,17,19).
What are the key properties of N-[(2,4-dimethyl-1,3-oxazol-5-yl)methyl]-6-propan-2-ylpyridine-3-carboxamide?
N-[(2,4-dimethyl-1,3-oxazol-5-yl)methyl]-6-propan-2-ylpyridine-3-carboxamide has a molecular weight of 273.34 g/mol, XLogP of 2.74, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,4-dimethyl-1,3-oxazol-5-yl)methyl]-6-propan-2-ylpyridine-3-carboxamide is sourced from PubChem (CID 136545101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).