N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]-2-pyridin-3-ylacetamide

C23H24N4O3 — CID 10309749

IUPACN-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]-2-pyridin-3-ylacetamide
SMILESO=C(Cc1cccnc1)NCc1ccc(-c2nc(C(=O)N3CCCCC3)co2)cc1
InChIInChI=1S/C23H24N4O3/c28-21(13-18-5-4-10-24-14-18)25-15-17-6-8-19(9-7-17)22-26-20(16-30-22)23(29)27-11-2-1-3-12-27/h4-10,14,16H,1-3,11-13,15H2,(H,25,28)
InChIKeyVAWJLROSXSJRFC-UHFFFAOYSA-N
MW404.47 g/mol
LogP3.22
Rot. Bonds6

About N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]-2-pyridin-3-ylacetamide

N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]-2-pyridin-3-ylacetamide (PubChem CID 10309749) has the molecular formula C23H24N4O3 and a molecular weight of 404.47 g/mol. Its IUPAC name is N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]-2-pyridin-3-ylacetamide.

Molecular Properties

Compound NameN-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]-2-pyridin-3-ylacetamide
PubChem CID10309749
Molecular FormulaC23H24N4O3
Molecular Weight404.47 g/mol
Exact Mass404.18
IUPAC NameN-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]-2-pyridin-3-ylacetamide
SMILESO=C(Cc1cccnc1)NCc1ccc(-c2nc(C(=O)N3CCCCC3)co2)cc1
InChIInChI=1S/C23H24N4O3/c28-21(13-18-5-4-10-24-14-18)25-15-17-6-8-19(9-7-17)22-26-20(16-30-22)23(29)27-11-2-1-3-12-27/h4-10,14,16H,1-3,11-13,15H2,(H,25,28)
InChIKeyVAWJLROSXSJRFC-UHFFFAOYSA-N
XLogP3.22
TPSA88.33 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.47
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]-2-pyridin-3-ylacetamide?
The IUPAC name of N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]-2-pyridin-3-ylacetamide (CID 10309749) is N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]-2-pyridin-3-ylacetamide.
What is the SMILES notation for N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]-2-pyridin-3-ylacetamide?
The canonical SMILES for N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]-2-pyridin-3-ylacetamide is O=C(Cc1cccnc1)NCc1ccc(-c2nc(C(=O)N3CCCCC3)co2)cc1.
What is the InChIKey of N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]-2-pyridin-3-ylacetamide?
The InChIKey is VAWJLROSXSJRFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O3/c28-21(13-18-5-4-10-24-14-18)25-15-17-6-8-19(9-7-17)22-26-20(16-30-22)23(29)27-11-2-1-3-12-27/h4-10,14,16H,1-3,11-13,15H2,(H,25,28).
What are the key properties of N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]-2-pyridin-3-ylacetamide?
N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]-2-pyridin-3-ylacetamide has a molecular weight of 404.47 g/mol, XLogP of 3.22, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]-2-pyridin-3-ylacetamide is sourced from PubChem (CID 10309749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).