2-(2-methylphenyl)-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]acetamide

C19H23N3O2 — CID 32586117

IUPAC2-(2-methylphenyl)-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]acetamide
SMILESCc1ccccc1CC(=O)NCc1ccnc(N2CCOCC2)c1
InChIInChI=1S/C19H23N3O2/c1-15-4-2-3-5-17(15)13-19(23)21-14-16-6-7-20-18(12-16)22-8-10-24-11-9-22/h2-7,12H,8-11,13-14H2,1H3,(H,21,23)
InChIKeyPQFISUHDJUBFMJ-UHFFFAOYSA-N
MW325.41 g/mol
LogP2.09
Rot. Bonds5

About 2-(2-methylphenyl)-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]acetamide

2-(2-methylphenyl)-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]acetamide (PubChem CID 32586117) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is 2-(2-methylphenyl)-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]acetamide.

Molecular Properties

Compound Name2-(2-methylphenyl)-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]acetamide
PubChem CID32586117
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC Name2-(2-methylphenyl)-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]acetamide
SMILESCc1ccccc1CC(=O)NCc1ccnc(N2CCOCC2)c1
InChIInChI=1S/C19H23N3O2/c1-15-4-2-3-5-17(15)13-19(23)21-14-16-6-7-20-18(12-16)22-8-10-24-11-9-22/h2-7,12H,8-11,13-14H2,1H3,(H,21,23)
InChIKeyPQFISUHDJUBFMJ-UHFFFAOYSA-N
XLogP2.09
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methylphenyl)-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]acetamide?
The IUPAC name of 2-(2-methylphenyl)-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]acetamide (CID 32586117) is 2-(2-methylphenyl)-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]acetamide.
What is the SMILES notation for 2-(2-methylphenyl)-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]acetamide?
The canonical SMILES for 2-(2-methylphenyl)-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]acetamide is Cc1ccccc1CC(=O)NCc1ccnc(N2CCOCC2)c1.
What is the InChIKey of 2-(2-methylphenyl)-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]acetamide?
The InChIKey is PQFISUHDJUBFMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-15-4-2-3-5-17(15)13-19(23)21-14-16-6-7-20-18(12-16)22-8-10-24-11-9-22/h2-7,12H,8-11,13-14H2,1H3,(H,21,23).
What are the key properties of 2-(2-methylphenyl)-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]acetamide?
2-(2-methylphenyl)-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]acetamide has a molecular weight of 325.41 g/mol, XLogP of 2.09, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylphenyl)-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]acetamide is sourced from PubChem (CID 32586117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).