N-[[3-(6-methoxy-3-pyridinyl)-4-methylmorpholin-2-yl]methyl]propan-1-amine

C15H25N3O2 — CID 114938569

IUPACN-[[3-(6-methoxy-3-pyridinyl)-4-methylmorpholin-2-yl]methyl]propan-1-amine
SMILESCCCNCC1OCCN(C)C1c1ccc(OC)nc1
InChIInChI=1S/C15H25N3O2/c1-4-7-16-11-13-15(18(2)8-9-20-13)12-5-6-14(19-3)17-10-12/h5-6,10,13,15-16H,4,7-9,11H2,1-3H3
InChIKeyYKJHBCZAPBHXBM-UHFFFAOYSA-N
MW279.38 g/mol
LogP1.46
Rot. Bonds6

About N-[[3-(6-methoxy-3-pyridinyl)-4-methylmorpholin-2-yl]methyl]propan-1-amine

N-[[3-(6-methoxy-3-pyridinyl)-4-methylmorpholin-2-yl]methyl]propan-1-amine (PubChem CID 114938569) has the molecular formula C15H25N3O2 and a molecular weight of 279.38 g/mol. Its IUPAC name is N-[[3-(6-methoxy-3-pyridinyl)-4-methylmorpholin-2-yl]methyl]propan-1-amine.

Molecular Properties

Compound NameN-[[3-(6-methoxy-3-pyridinyl)-4-methylmorpholin-2-yl]methyl]propan-1-amine
PubChem CID114938569
Molecular FormulaC15H25N3O2
Molecular Weight279.38 g/mol
Exact Mass279.19
IUPAC NameN-[[3-(6-methoxy-3-pyridinyl)-4-methylmorpholin-2-yl]methyl]propan-1-amine
SMILESCCCNCC1OCCN(C)C1c1ccc(OC)nc1
InChIInChI=1S/C15H25N3O2/c1-4-7-16-11-13-15(18(2)8-9-20-13)12-5-6-14(19-3)17-10-12/h5-6,10,13,15-16H,4,7-9,11H2,1-3H3
InChIKeyYKJHBCZAPBHXBM-UHFFFAOYSA-N
XLogP1.46
TPSA46.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-[[3-(3-chloro-4-methoxyphenyl)-4-methylmorpholin-2-yl]methyl]ethanamine
CID 65021885
[3-(6-methoxy-3-pyridinyl)-4-propan-2-ylmorpholin-2-yl]methanamine
CID 114938575
6-methoxy-N-[[(2S,3S)-4-methyl-3-(3-methylimidazol-4-yl)morpholin-2-yl]methyl]pyridine-3-carboxamide
CID 154801391
1-[2-(6-methoxy-3-pyridinyl)-1-methylazepan-3-yl]-N-methylmethanamine
CID 114938579
2-(6-methoxy-3-pyridinyl)-1-methylpiperidin-3-amine
CID 114938614
N-methyl-1-[(2S,3S)-4-methyl-3-(1-methylpyrazol-4-yl)morpholin-2-yl]methanamine
CID 122164329
5-(2-ethylcyclopropyl)-2-methoxypyridine
CID 59988749
N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]-1-[(2S,3S)-4-methyl-3-phenylmorpholin-2-yl]methanamine
CID 128976699
N-[[3-(4-cyclopropylphenyl)-4-methylmorpholin-2-yl]methyl]propan-2-amine
CID 79971008
N-[[2-(6-methoxy-3-pyridinyl)oxan-3-yl]methyl]cyclopropanamine
CID 114938990
1-(1,4-dimethylpiperazin-2-yl)-N-[(6-methoxy-3-pyridinyl)methyl]methanamine
CID 114936760
N-[[3-(3-bromothiophen-2-yl)-4-methylmorpholin-2-yl]methyl]ethanamine
CID 115381375

Frequently Asked Questions

What is the IUPAC name of N-[[3-(6-methoxy-3-pyridinyl)-4-methylmorpholin-2-yl]methyl]propan-1-amine?
The IUPAC name of N-[[3-(6-methoxy-3-pyridinyl)-4-methylmorpholin-2-yl]methyl]propan-1-amine (CID 114938569) is N-[[3-(6-methoxy-3-pyridinyl)-4-methylmorpholin-2-yl]methyl]propan-1-amine.
What is the SMILES notation for N-[[3-(6-methoxy-3-pyridinyl)-4-methylmorpholin-2-yl]methyl]propan-1-amine?
The canonical SMILES for N-[[3-(6-methoxy-3-pyridinyl)-4-methylmorpholin-2-yl]methyl]propan-1-amine is CCCNCC1OCCN(C)C1c1ccc(OC)nc1.
What is the InChIKey of N-[[3-(6-methoxy-3-pyridinyl)-4-methylmorpholin-2-yl]methyl]propan-1-amine?
The InChIKey is YKJHBCZAPBHXBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2/c1-4-7-16-11-13-15(18(2)8-9-20-13)12-5-6-14(19-3)17-10-12/h5-6,10,13,15-16H,4,7-9,11H2,1-3H3.
What are the key properties of N-[[3-(6-methoxy-3-pyridinyl)-4-methylmorpholin-2-yl]methyl]propan-1-amine?
N-[[3-(6-methoxy-3-pyridinyl)-4-methylmorpholin-2-yl]methyl]propan-1-amine has a molecular weight of 279.38 g/mol, XLogP of 1.46, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(6-methoxy-3-pyridinyl)-4-methylmorpholin-2-yl]methyl]propan-1-amine is sourced from PubChem (CID 114938569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).