2-(2-methyl-6-phenylmorpholine-4-carbonyl)pyridine-4-carboxylic acid

C18H18N2O4 — CID 122055413

IUPAC2-(2-methyl-6-phenylmorpholine-4-carbonyl)pyridine-4-carboxylic acid
SMILESCC1CN(C(=O)c2cc(C(=O)O)ccn2)CC(c2ccccc2)O1
InChIInChI=1S/C18H18N2O4/c1-12-10-20(11-16(24-12)13-5-3-2-4-6-13)17(21)15-9-14(18(22)23)7-8-19-15/h2-9,12,16H,10-11H2,1H3,(H,22,23)
InChIKeyZPUSPOGPGQSIKB-UHFFFAOYSA-N
MW326.35 g/mol
LogP2.38
Rot. Bonds3

About 2-(2-methyl-6-phenylmorpholine-4-carbonyl)pyridine-4-carboxylic acid

2-(2-methyl-6-phenylmorpholine-4-carbonyl)pyridine-4-carboxylic acid (PubChem CID 122055413) has the molecular formula C18H18N2O4 and a molecular weight of 326.35 g/mol. Its IUPAC name is 2-(2-methyl-6-phenylmorpholine-4-carbonyl)pyridine-4-carboxylic acid.

Molecular Properties

Compound Name2-(2-methyl-6-phenylmorpholine-4-carbonyl)pyridine-4-carboxylic acid
PubChem CID122055413
Molecular FormulaC18H18N2O4
Molecular Weight326.35 g/mol
Exact Mass326.13
IUPAC Name2-(2-methyl-6-phenylmorpholine-4-carbonyl)pyridine-4-carboxylic acid
SMILESCC1CN(C(=O)c2cc(C(=O)O)ccn2)CC(c2ccccc2)O1
InChIInChI=1S/C18H18N2O4/c1-12-10-20(11-16(24-12)13-5-3-2-4-6-13)17(21)15-9-14(18(22)23)7-8-19-15/h2-9,12,16H,10-11H2,1H3,(H,22,23)
InChIKeyZPUSPOGPGQSIKB-UHFFFAOYSA-N
XLogP2.38
TPSA79.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.35
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(2-methyl-6-phenylmorpholine-4-carbonyl)pyridine-4-carboxylic acid 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

2-[2-(4-fluorophenyl)-6-methylmorpholine-4-carbonyl]pyridine-4-carboxylic acid
CID 122055790
(2-methyl-6-phenylmorpholin-4-yl)-pyrazin-2-ylmethanone
CID 47914748
[(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-pyrazin-2-ylmethanone
CID 94823256
(2-methyl-6-phenylmorpholin-4-yl)-phenylmethanone
CID 47914795
5-[(2R,6S)-2-methyl-6-phenylmorpholine-4-carbonyl]pyridine-2-carboxylic acid
CID 124694837
5-[(2S,6S)-2-methyl-6-phenylmorpholine-4-carbonyl]pyridine-2-carboxylic acid
CID 124692496
5-(2-methyl-6-phenylmorpholine-4-carbonyl)pyridine-2-carboxylic acid
CID 122158408
[2-(cyclopropylamino)-4-pyridinyl]-[(2S,6R)-2-methyl-6-phenylmorpholin-4-yl]methanone
CID 94820867
5-(2-methyl-6-phenylmorpholine-4-carbonyl)-1H-pyridin-2-one
CID 47914673
5-[(2S,6S)-2-methyl-6-phenylmorpholine-4-carbonyl]-1H-pyridin-2-one
CID 95583766
2-[[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]carbamoyl]pyridine-4-carboxylic acid
CID 122055363
2-[[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]methylcarbamoyl]pyridine-4-carboxylic acid
CID 122055437

Frequently Asked Questions

What is the IUPAC name of 2-(2-methyl-6-phenylmorpholine-4-carbonyl)pyridine-4-carboxylic acid?
The IUPAC name of 2-(2-methyl-6-phenylmorpholine-4-carbonyl)pyridine-4-carboxylic acid (CID 122055413) is 2-(2-methyl-6-phenylmorpholine-4-carbonyl)pyridine-4-carboxylic acid.
What is the SMILES notation for 2-(2-methyl-6-phenylmorpholine-4-carbonyl)pyridine-4-carboxylic acid?
The canonical SMILES for 2-(2-methyl-6-phenylmorpholine-4-carbonyl)pyridine-4-carboxylic acid is CC1CN(C(=O)c2cc(C(=O)O)ccn2)CC(c2ccccc2)O1.
What is the InChIKey of 2-(2-methyl-6-phenylmorpholine-4-carbonyl)pyridine-4-carboxylic acid?
The InChIKey is ZPUSPOGPGQSIKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O4/c1-12-10-20(11-16(24-12)13-5-3-2-4-6-13)17(21)15-9-14(18(22)23)7-8-19-15/h2-9,12,16H,10-11H2,1H3,(H,22,23).
What are the key properties of 2-(2-methyl-6-phenylmorpholine-4-carbonyl)pyridine-4-carboxylic acid?
2-(2-methyl-6-phenylmorpholine-4-carbonyl)pyridine-4-carboxylic acid has a molecular weight of 326.35 g/mol, XLogP of 2.38, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyl-6-phenylmorpholine-4-carbonyl)pyridine-4-carboxylic acid is sourced from PubChem (CID 122055413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).