N-[5-[[1-(1,3-oxazole-4-carbonyl)piperidin-4-yl]methyl]-2-pyridinyl]-1,3-oxazole-4-carboxamide

C19H19N5O4 — CID 136554366

IUPACN-[5-[[1-(1,3-oxazole-4-carbonyl)piperidin-4-yl]methyl]-2-pyridinyl]-1,3-oxazole-4-carboxamide
SMILESO=C(Nc1ccc(CC2CCN(C(=O)c3cocn3)CC2)cn1)c1cocn1
InChIInChI=1S/C19H19N5O4/c25-18(15-9-27-11-21-15)23-17-2-1-14(8-20-17)7-13-3-5-24(6-4-13)19(26)16-10-28-12-22-16/h1-2,8-13H,3-7H2,(H,20,23,25)
InChIKeyNZVYRORNAZNJGX-UHFFFAOYSA-N
MW381.39 g/mol
LogP2.40
Rot. Bonds5

About N-[5-[[1-(1,3-oxazole-4-carbonyl)piperidin-4-yl]methyl]-2-pyridinyl]-1,3-oxazole-4-carboxamide

N-[5-[[1-(1,3-oxazole-4-carbonyl)piperidin-4-yl]methyl]-2-pyridinyl]-1,3-oxazole-4-carboxamide (PubChem CID 136554366) has the molecular formula C19H19N5O4 and a molecular weight of 381.39 g/mol. Its IUPAC name is N-[5-[[1-(1,3-oxazole-4-carbonyl)piperidin-4-yl]methyl]-2-pyridinyl]-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-[5-[[1-(1,3-oxazole-4-carbonyl)piperidin-4-yl]methyl]-2-pyridinyl]-1,3-oxazole-4-carboxamide
PubChem CID136554366
Molecular FormulaC19H19N5O4
Molecular Weight381.39 g/mol
Exact Mass381.14
IUPAC NameN-[5-[[1-(1,3-oxazole-4-carbonyl)piperidin-4-yl]methyl]-2-pyridinyl]-1,3-oxazole-4-carboxamide
SMILESO=C(Nc1ccc(CC2CCN(C(=O)c3cocn3)CC2)cn1)c1cocn1
InChIInChI=1S/C19H19N5O4/c25-18(15-9-27-11-21-15)23-17-2-1-14(8-20-17)7-13-3-5-24(6-4-13)19(26)16-10-28-12-22-16/h1-2,8-13H,3-7H2,(H,20,23,25)
InChIKeyNZVYRORNAZNJGX-UHFFFAOYSA-N
XLogP2.40
TPSA114.36 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.39
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[5-[[1-(1,3-oxazole-4-carbonyl)piperidin-4-yl]methyl]-2-pyridinyl]-1,3-oxazole-4-carboxamide?
The IUPAC name of N-[5-[[1-(1,3-oxazole-4-carbonyl)piperidin-4-yl]methyl]-2-pyridinyl]-1,3-oxazole-4-carboxamide (CID 136554366) is N-[5-[[1-(1,3-oxazole-4-carbonyl)piperidin-4-yl]methyl]-2-pyridinyl]-1,3-oxazole-4-carboxamide.
What is the SMILES notation for N-[5-[[1-(1,3-oxazole-4-carbonyl)piperidin-4-yl]methyl]-2-pyridinyl]-1,3-oxazole-4-carboxamide?
The canonical SMILES for N-[5-[[1-(1,3-oxazole-4-carbonyl)piperidin-4-yl]methyl]-2-pyridinyl]-1,3-oxazole-4-carboxamide is O=C(Nc1ccc(CC2CCN(C(=O)c3cocn3)CC2)cn1)c1cocn1.
What is the InChIKey of N-[5-[[1-(1,3-oxazole-4-carbonyl)piperidin-4-yl]methyl]-2-pyridinyl]-1,3-oxazole-4-carboxamide?
The InChIKey is NZVYRORNAZNJGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N5O4/c25-18(15-9-27-11-21-15)23-17-2-1-14(8-20-17)7-13-3-5-24(6-4-13)19(26)16-10-28-12-22-16/h1-2,8-13H,3-7H2,(H,20,23,25).
What are the key properties of N-[5-[[1-(1,3-oxazole-4-carbonyl)piperidin-4-yl]methyl]-2-pyridinyl]-1,3-oxazole-4-carboxamide?
N-[5-[[1-(1,3-oxazole-4-carbonyl)piperidin-4-yl]methyl]-2-pyridinyl]-1,3-oxazole-4-carboxamide has a molecular weight of 381.39 g/mol, XLogP of 2.40, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[[1-(1,3-oxazole-4-carbonyl)piperidin-4-yl]methyl]-2-pyridinyl]-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 136554366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).