2,3-dimethyl-N-[(2S)-2-morpholin-4-yl-2-pyridin-4-ylethyl]benzamide

C20H25N3O2 — CID 124647353

IUPAC2,3-dimethyl-N-[(2S)-2-morpholin-4-yl-2-pyridin-4-ylethyl]benzamide
SMILESCc1cccc(C(=O)NC[C@H](c2ccncc2)N2CCOCC2)c1C
InChIInChI=1S/C20H25N3O2/c1-15-4-3-5-18(16(15)2)20(24)22-14-19(17-6-8-21-9-7-17)23-10-12-25-13-11-23/h3-9,19H,10-14H2,1-2H3,(H,22,24)/t19-/m1/s1
InChIKeyDHGOTTGXVDLXFC-LJQANCHMSA-N
MW339.44 g/mol
LogP2.50
Rot. Bonds5

About 2,3-dimethyl-N-[(2S)-2-morpholin-4-yl-2-pyridin-4-ylethyl]benzamide

2,3-dimethyl-N-[(2S)-2-morpholin-4-yl-2-pyridin-4-ylethyl]benzamide (PubChem CID 124647353) has the molecular formula C20H25N3O2 and a molecular weight of 339.44 g/mol. Its IUPAC name is 2,3-dimethyl-N-[(2S)-2-morpholin-4-yl-2-pyridin-4-ylethyl]benzamide.

Molecular Properties

Compound Name2,3-dimethyl-N-[(2S)-2-morpholin-4-yl-2-pyridin-4-ylethyl]benzamide
PubChem CID124647353
Molecular FormulaC20H25N3O2
Molecular Weight339.44 g/mol
Exact Mass339.19
IUPAC Name2,3-dimethyl-N-[(2S)-2-morpholin-4-yl-2-pyridin-4-ylethyl]benzamide
SMILESCc1cccc(C(=O)NC[C@H](c2ccncc2)N2CCOCC2)c1C
InChIInChI=1S/C20H25N3O2/c1-15-4-3-5-18(16(15)2)20(24)22-14-19(17-6-8-21-9-7-17)23-10-12-25-13-11-23/h3-9,19H,10-14H2,1-2H3,(H,22,24)/t19-/m1/s1
InChIKeyDHGOTTGXVDLXFC-LJQANCHMSA-N
XLogP2.50
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,3-dimethyl-N-[(2R)-2-morpholin-4-yl-2-pyridin-4-ylethyl]benzamide
CID 124647352
N-[(2R)-2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-2,3-dimethylbenzamide
CID 30878247
2,6-dimethyl-N-[(2R)-2-morpholin-4-yl-2-pyridin-4-ylethyl]pyrimidine-4-carboxamide
CID 95127691
N-[2-(3-methoxyphenyl)-2-morpholin-4-ylethyl]-2-methylbenzamide
CID 44902864
N-[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]-2,3-dimethylbenzamide
CID 35047300
2-methyl-N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)benzamide
CID 16931649
2-fluoro-N-[(2S)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide
CID 31460592
2-fluoro-N-(2-morpholin-4-yl-2-phenylethyl)pyridine-3-carboxamide
CID 91197833
2-amino-N-[2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide;dihydrochloride
CID 119946754
N-[2-(3-methoxyphenyl)-2-morpholin-4-ylethyl]pyridine-4-carboxamide
CID 112506741
N-[2-[4-(dimethylamino)phenyl]-2-morpholin-4-ylethyl]-2-methyl-3-nitrobenzamide
CID 43956139
N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-2,3-dimethylbenzamide
CID 43007764

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-N-[(2S)-2-morpholin-4-yl-2-pyridin-4-ylethyl]benzamide?
The IUPAC name of 2,3-dimethyl-N-[(2S)-2-morpholin-4-yl-2-pyridin-4-ylethyl]benzamide (CID 124647353) is 2,3-dimethyl-N-[(2S)-2-morpholin-4-yl-2-pyridin-4-ylethyl]benzamide.
What is the SMILES notation for 2,3-dimethyl-N-[(2S)-2-morpholin-4-yl-2-pyridin-4-ylethyl]benzamide?
The canonical SMILES for 2,3-dimethyl-N-[(2S)-2-morpholin-4-yl-2-pyridin-4-ylethyl]benzamide is Cc1cccc(C(=O)NC[C@H](c2ccncc2)N2CCOCC2)c1C.
What is the InChIKey of 2,3-dimethyl-N-[(2S)-2-morpholin-4-yl-2-pyridin-4-ylethyl]benzamide?
The InChIKey is DHGOTTGXVDLXFC-LJQANCHMSA-N. The full InChI is InChI=1S/C20H25N3O2/c1-15-4-3-5-18(16(15)2)20(24)22-14-19(17-6-8-21-9-7-17)23-10-12-25-13-11-23/h3-9,19H,10-14H2,1-2H3,(H,22,24)/t19-/m1/s1.
What are the key properties of 2,3-dimethyl-N-[(2S)-2-morpholin-4-yl-2-pyridin-4-ylethyl]benzamide?
2,3-dimethyl-N-[(2S)-2-morpholin-4-yl-2-pyridin-4-ylethyl]benzamide has a molecular weight of 339.44 g/mol, XLogP of 2.50, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-N-[(2S)-2-morpholin-4-yl-2-pyridin-4-ylethyl]benzamide is sourced from PubChem (CID 124647353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).