(2R,3S)-N-[6-(3,4-dimethylphenoxy)-3-pyridinyl]-2-methylmorpholine-3-carboxamide

C19H23N3O3 — CID 120939088

IUPAC(2R,3S)-N-[6-(3,4-dimethylphenoxy)-3-pyridinyl]-2-methylmorpholine-3-carboxamide
SMILESCc1ccc(Oc2ccc(NC(=O)[C@H]3NCCO[C@@H]3C)cn2)cc1C
InChIInChI=1S/C19H23N3O3/c1-12-4-6-16(10-13(12)2)25-17-7-5-15(11-21-17)22-19(23)18-14(3)24-9-8-20-18/h4-7,10-11,14,18,20H,8-9H2,1-3H3,(H,22,23)/t14-,18+/m1/s1
InChIKeyPTSRCHAJYKITNL-KDOFPFPSSA-N
MW341.41 g/mol
LogP2.81
Rot. Bonds4

About (2R,3S)-N-[6-(3,4-dimethylphenoxy)-3-pyridinyl]-2-methylmorpholine-3-carboxamide

(2R,3S)-N-[6-(3,4-dimethylphenoxy)-3-pyridinyl]-2-methylmorpholine-3-carboxamide (PubChem CID 120939088) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is (2R,3S)-N-[6-(3,4-dimethylphenoxy)-3-pyridinyl]-2-methylmorpholine-3-carboxamide.

Molecular Properties

Compound Name(2R,3S)-N-[6-(3,4-dimethylphenoxy)-3-pyridinyl]-2-methylmorpholine-3-carboxamide
PubChem CID120939088
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC Name(2R,3S)-N-[6-(3,4-dimethylphenoxy)-3-pyridinyl]-2-methylmorpholine-3-carboxamide
SMILESCc1ccc(Oc2ccc(NC(=O)[C@H]3NCCO[C@@H]3C)cn2)cc1C
InChIInChI=1S/C19H23N3O3/c1-12-4-6-16(10-13(12)2)25-17-7-5-15(11-21-17)22-19(23)18-14(3)24-9-8-20-18/h4-7,10-11,14,18,20H,8-9H2,1-3H3,(H,22,23)/t14-,18+/m1/s1
InChIKeyPTSRCHAJYKITNL-KDOFPFPSSA-N
XLogP2.81
TPSA72.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze (2R,3S)-N-[6-(3,4-dimethylphenoxy)-3-pyridinyl]-2-methylmorpholine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2R,3S)-N-[6-(2-methoxy-4-methylphenoxy)-3-pyridinyl]-2-methylmorpholine-3-carboxamide
CID 120939327
(2R,3S)-2-methyl-N-(6-morpholin-4-yl-3-pyridinyl)morpholine-3-carboxamide
CID 120938472
3-amino-N-[6-(3,4-dimethylphenoxy)-3-pyridinyl]cyclopentane-1-carboxamide
CID 119849038
N-[6-(3,4-dimethylphenoxy)-3-pyridinyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide
CID 55750200
(2R,3S)-N-[5-(4-fluorophenoxy)-2-pyridinyl]-2-methylmorpholine-3-carboxamide
CID 120941039
(2R,3S)-N-[6-(diethylamino)-3-pyridinyl]-2-methylmorpholine-3-carboxamide;dihydrochloride
CID 120938917
(2R,3S)-N-(4-acetamidophenyl)-2-methylmorpholine-3-carboxamide
CID 120916743
(2R,3S)-2-methyl-N-[4-methyl-3-(propan-2-ylcarbamoyl)phenyl]morpholine-3-carboxamide
CID 120931980
(2R,3S)-N-(4-iodophenyl)-2-methylmorpholine-3-carboxamide;hydrochloride
CID 120917297
N-[6-(3,4-dimethylphenoxy)-3-pyridinyl]-1-hydroxycyclopropane-1-carboxamide
CID 154846570
(2R,3S)-2-methyl-N-[4-(trifluoromethoxy)phenyl]morpholine-3-carboxamide
CID 120917325
(2R,3S)-2-methyl-N-[4-(4-methylsulfonylphenoxy)phenyl]morpholine-3-carboxamide
CID 120930531

Frequently Asked Questions

What is the IUPAC name of (2R,3S)-N-[6-(3,4-dimethylphenoxy)-3-pyridinyl]-2-methylmorpholine-3-carboxamide?
The IUPAC name of (2R,3S)-N-[6-(3,4-dimethylphenoxy)-3-pyridinyl]-2-methylmorpholine-3-carboxamide (CID 120939088) is (2R,3S)-N-[6-(3,4-dimethylphenoxy)-3-pyridinyl]-2-methylmorpholine-3-carboxamide.
What is the SMILES notation for (2R,3S)-N-[6-(3,4-dimethylphenoxy)-3-pyridinyl]-2-methylmorpholine-3-carboxamide?
The canonical SMILES for (2R,3S)-N-[6-(3,4-dimethylphenoxy)-3-pyridinyl]-2-methylmorpholine-3-carboxamide is Cc1ccc(Oc2ccc(NC(=O)[C@H]3NCCO[C@@H]3C)cn2)cc1C.
What is the InChIKey of (2R,3S)-N-[6-(3,4-dimethylphenoxy)-3-pyridinyl]-2-methylmorpholine-3-carboxamide?
The InChIKey is PTSRCHAJYKITNL-KDOFPFPSSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-12-4-6-16(10-13(12)2)25-17-7-5-15(11-21-17)22-19(23)18-14(3)24-9-8-20-18/h4-7,10-11,14,18,20H,8-9H2,1-3H3,(H,22,23)/t14-,18+/m1/s1.
What are the key properties of (2R,3S)-N-[6-(3,4-dimethylphenoxy)-3-pyridinyl]-2-methylmorpholine-3-carboxamide?
(2R,3S)-N-[6-(3,4-dimethylphenoxy)-3-pyridinyl]-2-methylmorpholine-3-carboxamide has a molecular weight of 341.41 g/mol, XLogP of 2.81, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3S)-N-[6-(3,4-dimethylphenoxy)-3-pyridinyl]-2-methylmorpholine-3-carboxamide is sourced from PubChem (CID 120939088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).