N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]indolizine-2-carboxamide

C19H15N3O3 — CID 22058517

IUPACN-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]indolizine-2-carboxamide
SMILESCOc1cc(NC(=O)c2cc3ccccn3c2)ccc1-c1cnco1
InChIInChI=1S/C19H15N3O3/c1-24-17-9-14(5-6-16(17)18-10-20-12-25-18)21-19(23)13-8-15-4-2-3-7-22(15)11-13/h2-12H,1H3,(H,21,23)
InChIKeySDAUDLDZTFWHSW-UHFFFAOYSA-N
MW333.35 g/mol
LogP3.86
Rot. Bonds4

About N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]indolizine-2-carboxamide

N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]indolizine-2-carboxamide (PubChem CID 22058517) has the molecular formula C19H15N3O3 and a molecular weight of 333.35 g/mol. Its IUPAC name is N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]indolizine-2-carboxamide.

Molecular Properties

Compound NameN-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]indolizine-2-carboxamide
PubChem CID22058517
Molecular FormulaC19H15N3O3
Molecular Weight333.35 g/mol
Exact Mass333.11
IUPAC NameN-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]indolizine-2-carboxamide
SMILESCOc1cc(NC(=O)c2cc3ccccn3c2)ccc1-c1cnco1
InChIInChI=1S/C19H15N3O3/c1-24-17-9-14(5-6-16(17)18-10-20-12-25-18)21-19(23)13-8-15-4-2-3-7-22(15)11-13/h2-12H,1H3,(H,21,23)
InChIKeySDAUDLDZTFWHSW-UHFFFAOYSA-N
XLogP3.86
TPSA68.77 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.35
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]indolizine-2-carboxamide?
The IUPAC name of N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]indolizine-2-carboxamide (CID 22058517) is N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]indolizine-2-carboxamide.
What is the SMILES notation for N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]indolizine-2-carboxamide?
The canonical SMILES for N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]indolizine-2-carboxamide is COc1cc(NC(=O)c2cc3ccccn3c2)ccc1-c1cnco1.
What is the InChIKey of N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]indolizine-2-carboxamide?
The InChIKey is SDAUDLDZTFWHSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N3O3/c1-24-17-9-14(5-6-16(17)18-10-20-12-25-18)21-19(23)13-8-15-4-2-3-7-22(15)11-13/h2-12H,1H3,(H,21,23).
What are the key properties of N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]indolizine-2-carboxamide?
N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]indolizine-2-carboxamide has a molecular weight of 333.35 g/mol, XLogP of 3.86, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]indolizine-2-carboxamide is sourced from PubChem (CID 22058517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).