[5-[benzyl(propan-2-yl)amino]-2-pyridinyl]-morpholin-4-ylmethanone

C20H25N3O2 — CID 109184622

IUPAC[5-[benzyl(propan-2-yl)amino]-2-pyridinyl]-morpholin-4-ylmethanone
SMILESCC(C)N(Cc1ccccc1)c1ccc(C(=O)N2CCOCC2)nc1
InChIInChI=1S/C20H25N3O2/c1-16(2)23(15-17-6-4-3-5-7-17)18-8-9-19(21-14-18)20(24)22-10-12-25-13-11-22/h3-9,14,16H,10-13,15H2,1-2H3
InChIKeyWGZCRYPJKIIEPN-UHFFFAOYSA-N
MW339.44 g/mol
LogP2.97
Rot. Bonds5

About [5-[benzyl(propan-2-yl)amino]-2-pyridinyl]-morpholin-4-ylmethanone

[5-[benzyl(propan-2-yl)amino]-2-pyridinyl]-morpholin-4-ylmethanone (PubChem CID 109184622) has the molecular formula C20H25N3O2 and a molecular weight of 339.44 g/mol. Its IUPAC name is [5-[benzyl(propan-2-yl)amino]-2-pyridinyl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[5-[benzyl(propan-2-yl)amino]-2-pyridinyl]-morpholin-4-ylmethanone
PubChem CID109184622
Molecular FormulaC20H25N3O2
Molecular Weight339.44 g/mol
Exact Mass339.19
IUPAC Name[5-[benzyl(propan-2-yl)amino]-2-pyridinyl]-morpholin-4-ylmethanone
SMILESCC(C)N(Cc1ccccc1)c1ccc(C(=O)N2CCOCC2)nc1
InChIInChI=1S/C20H25N3O2/c1-16(2)23(15-17-6-4-3-5-7-17)18-8-9-19(21-14-18)20(24)22-10-12-25-13-11-22/h3-9,14,16H,10-13,15H2,1-2H3
InChIKeyWGZCRYPJKIIEPN-UHFFFAOYSA-N
XLogP2.97
TPSA45.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

[5-[benzyl(propan-2-yl)amino]-2-pyridinyl]-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone
CID 109193808
5-[benzyl(propan-2-yl)amino]-N-butan-2-ylpyridine-2-carboxamide
CID 109181465
5-[benzyl(propan-2-yl)amino]-N-cyclopropylpyridine-2-carboxamide
CID 109179910
[5-(benzylamino)-2-pyridinyl]-morpholin-4-ylmethanone
CID 109184568
[6-[benzyl(methyl)amino]pyridazin-3-yl]-morpholin-4-ylmethanone
CID 109114629
morpholin-4-yl-[5-(2-phenylethylamino)-2-pyridinyl]methanone
CID 109184585
[2-[benzyl(methyl)amino]pyrimidin-4-yl]-morpholin-4-ylmethanone
CID 109300530
[5-[benzyl(methyl)amino]-2-pyridinyl]-(4-benzylpiperidin-1-yl)methanone
CID 109189255
N-benzyl-N-methyl-2-(morpholine-4-carbonyl)pyridine-4-carboxamide
CID 109082965
[4-[benzyl(ethyl)amino]-2-pyridinyl]-morpholin-4-ylmethanone
CID 109206409
azepan-1-yl-[2-[benzyl(propan-2-yl)amino]pyrimidin-4-yl]methanone
CID 109311628
[6-[benzyl(methyl)amino]pyrimidin-4-yl]-morpholin-4-ylmethanone
CID 109343534

Frequently Asked Questions

What is the IUPAC name of [5-[benzyl(propan-2-yl)amino]-2-pyridinyl]-morpholin-4-ylmethanone?
The IUPAC name of [5-[benzyl(propan-2-yl)amino]-2-pyridinyl]-morpholin-4-ylmethanone (CID 109184622) is [5-[benzyl(propan-2-yl)amino]-2-pyridinyl]-morpholin-4-ylmethanone.
What is the SMILES notation for [5-[benzyl(propan-2-yl)amino]-2-pyridinyl]-morpholin-4-ylmethanone?
The canonical SMILES for [5-[benzyl(propan-2-yl)amino]-2-pyridinyl]-morpholin-4-ylmethanone is CC(C)N(Cc1ccccc1)c1ccc(C(=O)N2CCOCC2)nc1.
What is the InChIKey of [5-[benzyl(propan-2-yl)amino]-2-pyridinyl]-morpholin-4-ylmethanone?
The InChIKey is WGZCRYPJKIIEPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O2/c1-16(2)23(15-17-6-4-3-5-7-17)18-8-9-19(21-14-18)20(24)22-10-12-25-13-11-22/h3-9,14,16H,10-13,15H2,1-2H3.
What are the key properties of [5-[benzyl(propan-2-yl)amino]-2-pyridinyl]-morpholin-4-ylmethanone?
[5-[benzyl(propan-2-yl)amino]-2-pyridinyl]-morpholin-4-ylmethanone has a molecular weight of 339.44 g/mol, XLogP of 2.97, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[benzyl(propan-2-yl)amino]-2-pyridinyl]-morpholin-4-ylmethanone is sourced from PubChem (CID 109184622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).