2-naphthalen-1-yloxy-N-(2-pyrimidin-2-yl-1,3-benzoxazol-5-yl)propanamide

C24H18N4O3 — CID 67473106

IUPAC2-naphthalen-1-yloxy-N-(2-pyrimidin-2-yl-1,3-benzoxazol-5-yl)propanamide
SMILESCC(Oc1cccc2ccccc12)C(=O)Nc1ccc2oc(-c3ncccn3)nc2c1
InChIInChI=1S/C24H18N4O3/c1-15(30-20-9-4-7-16-6-2-3-8-18(16)20)23(29)27-17-10-11-21-19(14-17)28-24(31-21)22-25-12-5-13-26-22/h2-15H,1H3,(H,27,29)
InChIKeyJEMRJBHXGAQYMP-UHFFFAOYSA-N
MW410.43 g/mol
LogP4.84
Rot. Bonds5

About 2-naphthalen-1-yloxy-N-(2-pyrimidin-2-yl-1,3-benzoxazol-5-yl)propanamide

2-naphthalen-1-yloxy-N-(2-pyrimidin-2-yl-1,3-benzoxazol-5-yl)propanamide (PubChem CID 67473106) has the molecular formula C24H18N4O3 and a molecular weight of 410.43 g/mol. Its IUPAC name is 2-naphthalen-1-yloxy-N-(2-pyrimidin-2-yl-1,3-benzoxazol-5-yl)propanamide.

Molecular Properties

Compound Name2-naphthalen-1-yloxy-N-(2-pyrimidin-2-yl-1,3-benzoxazol-5-yl)propanamide
PubChem CID67473106
Molecular FormulaC24H18N4O3
Molecular Weight410.43 g/mol
Exact Mass410.14
IUPAC Name2-naphthalen-1-yloxy-N-(2-pyrimidin-2-yl-1,3-benzoxazol-5-yl)propanamide
SMILESCC(Oc1cccc2ccccc12)C(=O)Nc1ccc2oc(-c3ncccn3)nc2c1
InChIInChI=1S/C24H18N4O3/c1-15(30-20-9-4-7-16-6-2-3-8-18(16)20)23(29)27-17-10-11-21-19(14-17)28-24(31-21)22-25-12-5-13-26-22/h2-15H,1H3,(H,27,29)
InChIKeyJEMRJBHXGAQYMP-UHFFFAOYSA-N
XLogP4.84
TPSA90.14 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.43
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-{4-[(6-{[3-(1,3-oxazol-5-yl)phenyl]amino}pyrazin-2-yl)oxy]naphthalen-1-yl}acetamide
CID 24863189
(2s)-2-(Naphthalen-1-Yloxy)-N-[2-(Pyridin-4-Yl)-1,3-Benzoxazol-5-Yl]propanamide
CID 71297189
3-methoxy-N-[2-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]benzamide
CID 1142615
3-ethoxy-N-(2-methyl-3-[1,3]oxazolo[4,5-b]pyridin-2-ylphenyl)benzamide
CID 1216135
N-(4-(3-(2-(methylamino)pyrimidin-4-yl)pyridin-2-yloxy)naphthalen-1-yl)benzo[d]oxazol-2-amine
CID 24983254
4-(2-(3,4-dihydro-2H-chromen-3-yl)benzo[d]oxazol-6-yl)pyrimidin-2-amine
CID 44563188
2-(1-naphthyloxy)-N-[2-(4-pyridyl)-1,3-benzoxazol-5-yl]propanamide
CID 70851038
2-[(4-chloro-1-naphthyl)oxy]-N-[2-(4-pyridyl)-1,3-benzoxazol-5-yl]propanamide
CID 71661897
3-methyl-2-(1-naphthyloxy)-N-[2-(4-pyridyl)-1,3-benzoxazol-5-yl]butanamide
CID 71662079
(2R)-2-(1-naphthyloxy)-N-[2-(4-pyridyl)-1,3-benzoxazol-5-yl]propanamide
CID 71662080
(2S)-2-(1-naphthylamino)-N-[2-(4-pyridyl)-1,3-benzoxazol-5-yl]propanamide
CID 71662776
2-(3,5-dimethylphenoxy)-N-[3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]acetamide
CID 1492665

Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-1-yloxy-N-(2-pyrimidin-2-yl-1,3-benzoxazol-5-yl)propanamide?
The IUPAC name of 2-naphthalen-1-yloxy-N-(2-pyrimidin-2-yl-1,3-benzoxazol-5-yl)propanamide (CID 67473106) is 2-naphthalen-1-yloxy-N-(2-pyrimidin-2-yl-1,3-benzoxazol-5-yl)propanamide.
What is the SMILES notation for 2-naphthalen-1-yloxy-N-(2-pyrimidin-2-yl-1,3-benzoxazol-5-yl)propanamide?
The canonical SMILES for 2-naphthalen-1-yloxy-N-(2-pyrimidin-2-yl-1,3-benzoxazol-5-yl)propanamide is CC(Oc1cccc2ccccc12)C(=O)Nc1ccc2oc(-c3ncccn3)nc2c1.
What is the InChIKey of 2-naphthalen-1-yloxy-N-(2-pyrimidin-2-yl-1,3-benzoxazol-5-yl)propanamide?
The InChIKey is JEMRJBHXGAQYMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18N4O3/c1-15(30-20-9-4-7-16-6-2-3-8-18(16)20)23(29)27-17-10-11-21-19(14-17)28-24(31-21)22-25-12-5-13-26-22/h2-15H,1H3,(H,27,29).
What are the key properties of 2-naphthalen-1-yloxy-N-(2-pyrimidin-2-yl-1,3-benzoxazol-5-yl)propanamide?
2-naphthalen-1-yloxy-N-(2-pyrimidin-2-yl-1,3-benzoxazol-5-yl)propanamide has a molecular weight of 410.43 g/mol, XLogP of 4.84, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-1-yloxy-N-(2-pyrimidin-2-yl-1,3-benzoxazol-5-yl)propanamide is sourced from PubChem (CID 67473106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).