2-[1-[7-(2-methyl-1,3-oxazol-5-yl)quinolin-5-yl]cyclopropyl]benzamide

C23H19N3O2 — CID 175878859

IUPAC2-[1-[7-(2-methyl-1,3-oxazol-5-yl)quinolin-5-yl]cyclopropyl]benzamide
SMILESCc1ncc(-c2cc(C3(c4ccccc4C(N)=O)CC3)c3cccnc3c2)o1
InChIInChI=1S/C23H19N3O2/c1-14-26-13-21(28-14)15-11-19(16-6-4-10-25-20(16)12-15)23(8-9-23)18-7-3-2-5-17(18)22(24)27/h2-7,10-13H,8-9H2,1H3,(H2,24,27)
InChIKeyJZROSRBFFUJWQG-UHFFFAOYSA-N
MW369.42 g/mol
LogP4.38
Rot. Bonds4

About 2-[1-[7-(2-methyl-1,3-oxazol-5-yl)quinolin-5-yl]cyclopropyl]benzamide

2-[1-[7-(2-methyl-1,3-oxazol-5-yl)quinolin-5-yl]cyclopropyl]benzamide (PubChem CID 175878859) has the molecular formula C23H19N3O2 and a molecular weight of 369.42 g/mol. Its IUPAC name is 2-[1-[7-(2-methyl-1,3-oxazol-5-yl)quinolin-5-yl]cyclopropyl]benzamide.

Molecular Properties

Compound Name2-[1-[7-(2-methyl-1,3-oxazol-5-yl)quinolin-5-yl]cyclopropyl]benzamide
PubChem CID175878859
Molecular FormulaC23H19N3O2
Molecular Weight369.42 g/mol
Exact Mass369.15
IUPAC Name2-[1-[7-(2-methyl-1,3-oxazol-5-yl)quinolin-5-yl]cyclopropyl]benzamide
SMILESCc1ncc(-c2cc(C3(c4ccccc4C(N)=O)CC3)c3cccnc3c2)o1
InChIInChI=1S/C23H19N3O2/c1-14-26-13-21(28-14)15-11-19(16-6-4-10-25-20(16)12-15)23(8-9-23)18-7-3-2-5-17(18)22(24)27/h2-7,10-13H,8-9H2,1H3,(H2,24,27)
InChIKeyJZROSRBFFUJWQG-UHFFFAOYSA-N
XLogP4.38
TPSA82.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.42
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[1-[7-(2-methyl-1,3-oxazol-5-yl)quinolin-5-yl]cyclopropyl]benzamide?
The IUPAC name of 2-[1-[7-(2-methyl-1,3-oxazol-5-yl)quinolin-5-yl]cyclopropyl]benzamide (CID 175878859) is 2-[1-[7-(2-methyl-1,3-oxazol-5-yl)quinolin-5-yl]cyclopropyl]benzamide.
What is the SMILES notation for 2-[1-[7-(2-methyl-1,3-oxazol-5-yl)quinolin-5-yl]cyclopropyl]benzamide?
The canonical SMILES for 2-[1-[7-(2-methyl-1,3-oxazol-5-yl)quinolin-5-yl]cyclopropyl]benzamide is Cc1ncc(-c2cc(C3(c4ccccc4C(N)=O)CC3)c3cccnc3c2)o1.
What is the InChIKey of 2-[1-[7-(2-methyl-1,3-oxazol-5-yl)quinolin-5-yl]cyclopropyl]benzamide?
The InChIKey is JZROSRBFFUJWQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N3O2/c1-14-26-13-21(28-14)15-11-19(16-6-4-10-25-20(16)12-15)23(8-9-23)18-7-3-2-5-17(18)22(24)27/h2-7,10-13H,8-9H2,1H3,(H2,24,27).
What are the key properties of 2-[1-[7-(2-methyl-1,3-oxazol-5-yl)quinolin-5-yl]cyclopropyl]benzamide?
2-[1-[7-(2-methyl-1,3-oxazol-5-yl)quinolin-5-yl]cyclopropyl]benzamide has a molecular weight of 369.42 g/mol, XLogP of 4.38, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[7-(2-methyl-1,3-oxazol-5-yl)quinolin-5-yl]cyclopropyl]benzamide is sourced from PubChem (CID 175878859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).