(2R)-2-benzyl-N-[(1S)-1-pyridin-4-ylpropyl]morpholine-4-carboxamide

C20H25N3O2 — CID 97337265

IUPAC(2R)-2-benzyl-N-[(1S)-1-pyridin-4-ylpropyl]morpholine-4-carboxamide
SMILESCC[C@H](NC(=O)N1CCO[C@H](Cc2ccccc2)C1)c1ccncc1
InChIInChI=1S/C20H25N3O2/c1-2-19(17-8-10-21-11-9-17)22-20(24)23-12-13-25-18(15-23)14-16-6-4-3-5-7-16/h3-11,18-19H,2,12-15H2,1H3,(H,22,24)/t18-,19+/m1/s1
InChIKeyJOCZXVGMNMFPAH-MOPGFXCFSA-N
MW339.44 g/mol
LogP3.19
Rot. Bonds5

About (2R)-2-benzyl-N-[(1S)-1-pyridin-4-ylpropyl]morpholine-4-carboxamide

(2R)-2-benzyl-N-[(1S)-1-pyridin-4-ylpropyl]morpholine-4-carboxamide (PubChem CID 97337265) has the molecular formula C20H25N3O2 and a molecular weight of 339.44 g/mol. Its IUPAC name is (2R)-2-benzyl-N-[(1S)-1-pyridin-4-ylpropyl]morpholine-4-carboxamide.

Molecular Properties

Compound Name(2R)-2-benzyl-N-[(1S)-1-pyridin-4-ylpropyl]morpholine-4-carboxamide
PubChem CID97337265
Molecular FormulaC20H25N3O2
Molecular Weight339.44 g/mol
Exact Mass339.19
IUPAC Name(2R)-2-benzyl-N-[(1S)-1-pyridin-4-ylpropyl]morpholine-4-carboxamide
SMILESCC[C@H](NC(=O)N1CCO[C@H](Cc2ccccc2)C1)c1ccncc1
InChIInChI=1S/C20H25N3O2/c1-2-19(17-8-10-21-11-9-17)22-20(24)23-12-13-25-18(15-23)14-16-6-4-3-5-7-16/h3-11,18-19H,2,12-15H2,1H3,(H,22,24)/t18-,19+/m1/s1
InChIKeyJOCZXVGMNMFPAH-MOPGFXCFSA-N
XLogP3.19
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-benzyl-N-(1-cyclopropylethyl)morpholine-4-carboxamide
CID 75445413
(2R)-2-(1-ethylpyrazol-4-yl)-N-[(1S)-1-pyridin-4-ylpropyl]morpholine-4-carboxamide
CID 99827534
(2R)-2-(1-ethylpyrazol-4-yl)-N-[(1R)-1-pyridin-4-ylpropyl]morpholine-4-carboxamide
CID 99827535
(2S)-2-benzyl-N-[(2S)-1-(1,2,4-triazol-1-yl)propan-2-yl]morpholine-4-carboxamide
CID 97336914
(2S)-2-benzyl-N-[(1R)-1-(5-methyl-1,3-thiazol-2-yl)ethyl]morpholine-4-carboxamide
CID 99819549
(2R)-2-benzyl-N-[(1-methylimidazol-2-yl)methyl]morpholine-4-carboxamide
CID 97336922
(2S)-2-benzyl-N-[(2R)-2-methyl-3-pyrazol-1-ylpropyl]morpholine-4-carboxamide
CID 97336903
2-benzyl-N-(2-methyl-3-pyrazol-1-ylpropyl)morpholine-4-carboxamide
CID 75445416
2-benzyl-N,N-diethylmorpholine-4-carboxamide
CID 110643919
2-benzyl-N-[(2-methylpyrazol-3-yl)methyl]morpholine-4-carboxamide
CID 75445414
2-benzyl-N-(3-fluoropropyl)morpholine-4-carboxamide
CID 84596460
2-benzyl-N-(1-ethylpiperidin-4-yl)morpholine-4-carboxamide
CID 84596388

Frequently Asked Questions

What is the IUPAC name of (2R)-2-benzyl-N-[(1S)-1-pyridin-4-ylpropyl]morpholine-4-carboxamide?
The IUPAC name of (2R)-2-benzyl-N-[(1S)-1-pyridin-4-ylpropyl]morpholine-4-carboxamide (CID 97337265) is (2R)-2-benzyl-N-[(1S)-1-pyridin-4-ylpropyl]morpholine-4-carboxamide.
What is the SMILES notation for (2R)-2-benzyl-N-[(1S)-1-pyridin-4-ylpropyl]morpholine-4-carboxamide?
The canonical SMILES for (2R)-2-benzyl-N-[(1S)-1-pyridin-4-ylpropyl]morpholine-4-carboxamide is CC[C@H](NC(=O)N1CCO[C@H](Cc2ccccc2)C1)c1ccncc1.
What is the InChIKey of (2R)-2-benzyl-N-[(1S)-1-pyridin-4-ylpropyl]morpholine-4-carboxamide?
The InChIKey is JOCZXVGMNMFPAH-MOPGFXCFSA-N. The full InChI is InChI=1S/C20H25N3O2/c1-2-19(17-8-10-21-11-9-17)22-20(24)23-12-13-25-18(15-23)14-16-6-4-3-5-7-16/h3-11,18-19H,2,12-15H2,1H3,(H,22,24)/t18-,19+/m1/s1.
What are the key properties of (2R)-2-benzyl-N-[(1S)-1-pyridin-4-ylpropyl]morpholine-4-carboxamide?
(2R)-2-benzyl-N-[(1S)-1-pyridin-4-ylpropyl]morpholine-4-carboxamide has a molecular weight of 339.44 g/mol, XLogP of 3.19, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-benzyl-N-[(1S)-1-pyridin-4-ylpropyl]morpholine-4-carboxamide is sourced from PubChem (CID 97337265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).