4-(5-morpholin-4-yl-3-pyridinyl)-2-propan-2-yloxybenzamide

C19H23N3O3 — CID 155531160

IUPAC4-(5-morpholin-4-yl-3-pyridinyl)-2-propan-2-yloxybenzamide
SMILESCC(C)Oc1cc(-c2cncc(N3CCOCC3)c2)ccc1C(N)=O
InChIInChI=1S/C19H23N3O3/c1-13(2)25-18-10-14(3-4-17(18)19(20)23)15-9-16(12-21-11-15)22-5-7-24-8-6-22/h3-4,9-13H,5-8H2,1-2H3,(H2,20,23)
InChIKeyABOJMONYYGQPBY-UHFFFAOYSA-N
MW341.41 g/mol
LogP2.47
Rot. Bonds5

About 4-(5-morpholin-4-yl-3-pyridinyl)-2-propan-2-yloxybenzamide

4-(5-morpholin-4-yl-3-pyridinyl)-2-propan-2-yloxybenzamide (PubChem CID 155531160) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is 4-(5-morpholin-4-yl-3-pyridinyl)-2-propan-2-yloxybenzamide.

Molecular Properties

Compound Name4-(5-morpholin-4-yl-3-pyridinyl)-2-propan-2-yloxybenzamide
PubChem CID155531160
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC Name4-(5-morpholin-4-yl-3-pyridinyl)-2-propan-2-yloxybenzamide
SMILESCC(C)Oc1cc(-c2cncc(N3CCOCC3)c2)ccc1C(N)=O
InChIInChI=1S/C19H23N3O3/c1-13(2)25-18-10-14(3-4-17(18)19(20)23)15-9-16(12-21-11-15)22-5-7-24-8-6-22/h3-4,9-13H,5-8H2,1-2H3,(H2,20,23)
InChIKeyABOJMONYYGQPBY-UHFFFAOYSA-N
XLogP2.47
TPSA77.68 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(5-morpholin-4-yl-3-pyridinyl)-2-propan-2-yloxybenzamide?
The IUPAC name of 4-(5-morpholin-4-yl-3-pyridinyl)-2-propan-2-yloxybenzamide (CID 155531160) is 4-(5-morpholin-4-yl-3-pyridinyl)-2-propan-2-yloxybenzamide.
What is the SMILES notation for 4-(5-morpholin-4-yl-3-pyridinyl)-2-propan-2-yloxybenzamide?
The canonical SMILES for 4-(5-morpholin-4-yl-3-pyridinyl)-2-propan-2-yloxybenzamide is CC(C)Oc1cc(-c2cncc(N3CCOCC3)c2)ccc1C(N)=O.
What is the InChIKey of 4-(5-morpholin-4-yl-3-pyridinyl)-2-propan-2-yloxybenzamide?
The InChIKey is ABOJMONYYGQPBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-13(2)25-18-10-14(3-4-17(18)19(20)23)15-9-16(12-21-11-15)22-5-7-24-8-6-22/h3-4,9-13H,5-8H2,1-2H3,(H2,20,23).
What are the key properties of 4-(5-morpholin-4-yl-3-pyridinyl)-2-propan-2-yloxybenzamide?
4-(5-morpholin-4-yl-3-pyridinyl)-2-propan-2-yloxybenzamide has a molecular weight of 341.41 g/mol, XLogP of 2.47, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-morpholin-4-yl-3-pyridinyl)-2-propan-2-yloxybenzamide is sourced from PubChem (CID 155531160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).