N-[6-(6-amino-3-pyridinyl)-2-propan-2-yloxy-3-pyridinyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide

C24H23N5O3 — CID 166108584

IUPACN-[6-(6-amino-3-pyridinyl)-2-propan-2-yloxy-3-pyridinyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
SMILESCc1onc(-c2ccccc2)c1C(=O)Nc1ccc(-c2ccc(N)nc2)nc1OC(C)C
InChIInChI=1S/C24H23N5O3/c1-14(2)31-24-19(11-10-18(28-24)17-9-12-20(25)26-13-17)27-23(30)21-15(3)32-29-22(21)16-7-5-4-6-8-16/h4-14H,1-3H3,(H2,25,26)(H,27,30)
InChIKeyAZVZTLNQRCHEIN-UHFFFAOYSA-N
MW429.48 g/mol
LogP4.73
Rot. Bonds6

About N-[6-(6-amino-3-pyridinyl)-2-propan-2-yloxy-3-pyridinyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide

N-[6-(6-amino-3-pyridinyl)-2-propan-2-yloxy-3-pyridinyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide (PubChem CID 166108584) has the molecular formula C24H23N5O3 and a molecular weight of 429.48 g/mol. Its IUPAC name is N-[6-(6-amino-3-pyridinyl)-2-propan-2-yloxy-3-pyridinyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-[6-(6-amino-3-pyridinyl)-2-propan-2-yloxy-3-pyridinyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
PubChem CID166108584
Molecular FormulaC24H23N5O3
Molecular Weight429.48 g/mol
Exact Mass429.18
IUPAC NameN-[6-(6-amino-3-pyridinyl)-2-propan-2-yloxy-3-pyridinyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
SMILESCc1onc(-c2ccccc2)c1C(=O)Nc1ccc(-c2ccc(N)nc2)nc1OC(C)C
InChIInChI=1S/C24H23N5O3/c1-14(2)31-24-19(11-10-18(28-24)17-9-12-20(25)26-13-17)27-23(30)21-15(3)32-29-22(21)16-7-5-4-6-8-16/h4-14H,1-3H3,(H2,25,26)(H,27,30)
InChIKeyAZVZTLNQRCHEIN-UHFFFAOYSA-N
XLogP4.73
TPSA116.16 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500429.48
LogP ≤ 54.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[6-(6-amino-3-pyridinyl)-2-propan-2-yloxy-3-pyridinyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide?
The IUPAC name of N-[6-(6-amino-3-pyridinyl)-2-propan-2-yloxy-3-pyridinyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide (CID 166108584) is N-[6-(6-amino-3-pyridinyl)-2-propan-2-yloxy-3-pyridinyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide.
What is the SMILES notation for N-[6-(6-amino-3-pyridinyl)-2-propan-2-yloxy-3-pyridinyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide?
The canonical SMILES for N-[6-(6-amino-3-pyridinyl)-2-propan-2-yloxy-3-pyridinyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide is Cc1onc(-c2ccccc2)c1C(=O)Nc1ccc(-c2ccc(N)nc2)nc1OC(C)C.
What is the InChIKey of N-[6-(6-amino-3-pyridinyl)-2-propan-2-yloxy-3-pyridinyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide?
The InChIKey is AZVZTLNQRCHEIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N5O3/c1-14(2)31-24-19(11-10-18(28-24)17-9-12-20(25)26-13-17)27-23(30)21-15(3)32-29-22(21)16-7-5-4-6-8-16/h4-14H,1-3H3,(H2,25,26)(H,27,30).
What are the key properties of N-[6-(6-amino-3-pyridinyl)-2-propan-2-yloxy-3-pyridinyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide?
N-[6-(6-amino-3-pyridinyl)-2-propan-2-yloxy-3-pyridinyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide has a molecular weight of 429.48 g/mol, XLogP of 4.73, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(6-amino-3-pyridinyl)-2-propan-2-yloxy-3-pyridinyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide is sourced from PubChem (CID 166108584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).