N-[1-[4-[2-(1H-indazol-5-ylamino)-1,3-oxazol-5-yl]phenyl]ethyl]acetamide

C20H19N5O2 — CID 69438537

IUPACN-[1-[4-[2-(1H-indazol-5-ylamino)-1,3-oxazol-5-yl]phenyl]ethyl]acetamide
SMILESCC(=O)NC(C)c1ccc(-c2cnc(Nc3ccc4[nH]ncc4c3)o2)cc1
InChIInChI=1S/C20H19N5O2/c1-12(23-13(2)26)14-3-5-15(6-4-14)19-11-21-20(27-19)24-17-7-8-18-16(9-17)10-22-25-18/h3-12H,1-2H3,(H,21,24)(H,22,25)(H,23,26)
InChIKeyZOOIJUSTMXHECE-UHFFFAOYSA-N
MW361.41 g/mol
LogP4.16
Rot. Bonds5

About N-[1-[4-[2-(1H-indazol-5-ylamino)-1,3-oxazol-5-yl]phenyl]ethyl]acetamide

N-[1-[4-[2-(1H-indazol-5-ylamino)-1,3-oxazol-5-yl]phenyl]ethyl]acetamide (PubChem CID 69438537) has the molecular formula C20H19N5O2 and a molecular weight of 361.41 g/mol. Its IUPAC name is N-[1-[4-[2-(1H-indazol-5-ylamino)-1,3-oxazol-5-yl]phenyl]ethyl]acetamide.

Molecular Properties

Compound NameN-[1-[4-[2-(1H-indazol-5-ylamino)-1,3-oxazol-5-yl]phenyl]ethyl]acetamide
PubChem CID69438537
Molecular FormulaC20H19N5O2
Molecular Weight361.41 g/mol
Exact Mass361.15
IUPAC NameN-[1-[4-[2-(1H-indazol-5-ylamino)-1,3-oxazol-5-yl]phenyl]ethyl]acetamide
SMILESCC(=O)NC(C)c1ccc(-c2cnc(Nc3ccc4[nH]ncc4c3)o2)cc1
InChIInChI=1S/C20H19N5O2/c1-12(23-13(2)26)14-3-5-15(6-4-14)19-11-21-20(27-19)24-17-7-8-18-16(9-17)10-22-25-18/h3-12H,1-2H3,(H,21,24)(H,22,25)(H,23,26)
InChIKeyZOOIJUSTMXHECE-UHFFFAOYSA-N
XLogP4.16
TPSA95.84 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.41
LogP ≤ 54.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[1-[4-[2-(1H-indazol-5-ylamino)-1,3-oxazol-5-yl]phenyl]ethyl]acetamide?
The IUPAC name of N-[1-[4-[2-(1H-indazol-5-ylamino)-1,3-oxazol-5-yl]phenyl]ethyl]acetamide (CID 69438537) is N-[1-[4-[2-(1H-indazol-5-ylamino)-1,3-oxazol-5-yl]phenyl]ethyl]acetamide.
What is the SMILES notation for N-[1-[4-[2-(1H-indazol-5-ylamino)-1,3-oxazol-5-yl]phenyl]ethyl]acetamide?
The canonical SMILES for N-[1-[4-[2-(1H-indazol-5-ylamino)-1,3-oxazol-5-yl]phenyl]ethyl]acetamide is CC(=O)NC(C)c1ccc(-c2cnc(Nc3ccc4[nH]ncc4c3)o2)cc1.
What is the InChIKey of N-[1-[4-[2-(1H-indazol-5-ylamino)-1,3-oxazol-5-yl]phenyl]ethyl]acetamide?
The InChIKey is ZOOIJUSTMXHECE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N5O2/c1-12(23-13(2)26)14-3-5-15(6-4-14)19-11-21-20(27-19)24-17-7-8-18-16(9-17)10-22-25-18/h3-12H,1-2H3,(H,21,24)(H,22,25)(H,23,26).
What are the key properties of N-[1-[4-[2-(1H-indazol-5-ylamino)-1,3-oxazol-5-yl]phenyl]ethyl]acetamide?
N-[1-[4-[2-(1H-indazol-5-ylamino)-1,3-oxazol-5-yl]phenyl]ethyl]acetamide has a molecular weight of 361.41 g/mol, XLogP of 4.16, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[4-[2-(1H-indazol-5-ylamino)-1,3-oxazol-5-yl]phenyl]ethyl]acetamide is sourced from PubChem (CID 69438537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).