N-[[4-(2,5-dimethylmorpholin-4-yl)-3-pyridinyl]methyl]propan-1-amine

C15H25N3O — CID 81246776

IUPACN-[[4-(2,5-dimethylmorpholin-4-yl)-3-pyridinyl]methyl]propan-1-amine
SMILESCCCNCc1cnccc1N1CC(C)OCC1C
InChIInChI=1S/C15H25N3O/c1-4-6-16-8-14-9-17-7-5-15(14)18-10-13(3)19-11-12(18)2/h5,7,9,12-13,16H,4,6,8,10-11H2,1-3H3
InChIKeyCRVBHKQACXLVEP-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.19
Rot. Bonds5

About N-[[4-(2,5-dimethylmorpholin-4-yl)-3-pyridinyl]methyl]propan-1-amine

N-[[4-(2,5-dimethylmorpholin-4-yl)-3-pyridinyl]methyl]propan-1-amine (PubChem CID 81246776) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is N-[[4-(2,5-dimethylmorpholin-4-yl)-3-pyridinyl]methyl]propan-1-amine.

Molecular Properties

Compound NameN-[[4-(2,5-dimethylmorpholin-4-yl)-3-pyridinyl]methyl]propan-1-amine
PubChem CID81246776
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC NameN-[[4-(2,5-dimethylmorpholin-4-yl)-3-pyridinyl]methyl]propan-1-amine
SMILESCCCNCc1cnccc1N1CC(C)OCC1C
InChIInChI=1S/C15H25N3O/c1-4-6-16-8-14-9-17-7-5-15(14)18-10-13(3)19-11-12(18)2/h5,7,9,12-13,16H,4,6,8,10-11H2,1-3H3
InChIKeyCRVBHKQACXLVEP-UHFFFAOYSA-N
XLogP2.19
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[[4-(2,3-dimethylpiperidin-1-yl)-3-pyridinyl]methyl]propan-1-amine
CID 81248433
3-(2,5-dimethylmorpholin-4-yl)pyridine-4-carbothioamide
CID 113269552
N-[[4-(3-ethyl-4-methylpiperazin-1-yl)-3-pyridinyl]methyl]propan-1-amine
CID 81247713
N-[[2-(5-ethyl-2-methylmorpholin-4-yl)-3-fluoro-4-pyridinyl]methyl]propan-1-amine
CID 105389592
8-(2,5-dimethylmorpholin-4-yl)isoquinolin-5-amine
CID 103137270
N-[[4-(3,4-dimethylpyrrolidin-1-yl)-3-pyridinyl]methyl]ethanamine
CID 81247739
N-[[4-(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-3-pyridinyl]methyl]ethanamine
CID 81254486
N-[[4-(3,4,5-trimethylpyrazol-1-yl)-3-pyridinyl]methyl]propan-1-amine
CID 81253654
N-[[4-cyclopropyl-2-(2,5-dimethylmorpholin-4-yl)-1,3-thiazol-5-yl]methyl]propan-1-amine
CID 63915788
N-[[3-bromo-4-[(2,5-dimethylmorpholin-4-yl)methyl]phenyl]methyl]propan-1-amine
CID 102769704
N-[[3-(4-methylazepan-1-yl)-4-pyridinyl]methyl]propan-1-amine
CID 105073921
N-[[2-(2,5-dimethylmorpholin-4-yl)-4-(methoxymethyl)-1,3-thiazol-5-yl]methyl]propan-1-amine
CID 107509788

Frequently Asked Questions

What is the IUPAC name of N-[[4-(2,5-dimethylmorpholin-4-yl)-3-pyridinyl]methyl]propan-1-amine?
The IUPAC name of N-[[4-(2,5-dimethylmorpholin-4-yl)-3-pyridinyl]methyl]propan-1-amine (CID 81246776) is N-[[4-(2,5-dimethylmorpholin-4-yl)-3-pyridinyl]methyl]propan-1-amine.
What is the SMILES notation for N-[[4-(2,5-dimethylmorpholin-4-yl)-3-pyridinyl]methyl]propan-1-amine?
The canonical SMILES for N-[[4-(2,5-dimethylmorpholin-4-yl)-3-pyridinyl]methyl]propan-1-amine is CCCNCc1cnccc1N1CC(C)OCC1C.
What is the InChIKey of N-[[4-(2,5-dimethylmorpholin-4-yl)-3-pyridinyl]methyl]propan-1-amine?
The InChIKey is CRVBHKQACXLVEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-4-6-16-8-14-9-17-7-5-15(14)18-10-13(3)19-11-12(18)2/h5,7,9,12-13,16H,4,6,8,10-11H2,1-3H3.
What are the key properties of N-[[4-(2,5-dimethylmorpholin-4-yl)-3-pyridinyl]methyl]propan-1-amine?
N-[[4-(2,5-dimethylmorpholin-4-yl)-3-pyridinyl]methyl]propan-1-amine has a molecular weight of 263.38 g/mol, XLogP of 2.19, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(2,5-dimethylmorpholin-4-yl)-3-pyridinyl]methyl]propan-1-amine is sourced from PubChem (CID 81246776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).