2-methoxy-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]ethanamine

C13H21N3O2 — CID 114056606

IUPAC2-methoxy-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]ethanamine
SMILESCOCCNCc1cccnc1N1CCOCC1
InChIInChI=1S/C13H21N3O2/c1-17-8-5-14-11-12-3-2-4-15-13(12)16-6-9-18-10-7-16/h2-4,14H,5-11H2,1H3
InChIKeyOVWHAMFSFOHRPW-UHFFFAOYSA-N
MW251.33 g/mol
LogP0.65
Rot. Bonds6

About 2-methoxy-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]ethanamine

2-methoxy-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]ethanamine (PubChem CID 114056606) has the molecular formula C13H21N3O2 and a molecular weight of 251.33 g/mol. Its IUPAC name is 2-methoxy-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]ethanamine.

Molecular Properties

Compound Name2-methoxy-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]ethanamine
PubChem CID114056606
Molecular FormulaC13H21N3O2
Molecular Weight251.33 g/mol
Exact Mass251.16
IUPAC Name2-methoxy-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]ethanamine
SMILESCOCCNCc1cccnc1N1CCOCC1
InChIInChI=1S/C13H21N3O2/c1-17-8-5-14-11-12-3-2-4-15-13(12)16-6-9-18-10-7-16/h2-4,14H,5-11H2,1H3
InChIKeyOVWHAMFSFOHRPW-UHFFFAOYSA-N
XLogP0.65
TPSA46.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 50.65
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

1-(2-methoxyethyl)-2-methyl-3-[(2-morpholin-4-yl-3-pyridinyl)methyl]guanidine;hydroiodide
CID 75419719
N-[(3,5-dimethoxyphenyl)methyl]-1-(2-morpholin-4-yl-3-pyridinyl)methanamine
CID 38051168
N-[(2,5-dimethoxyphenyl)methyl]-1-(2-morpholin-4-yl-3-pyridinyl)methanamine
CID 38051072
3-(2-methoxyethyl)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-1,2,4-thiadiazol-5-amine
CID 133335287
2-methyl-N-[[2-(1,4-oxazepan-4-yl)-3-pyridinyl]methyl]propan-1-amine
CID 62974256
N-[(3-chloro-4,5-dimethoxyphenyl)methyl]-1-(2-morpholin-4-yl-3-pyridinyl)methanamine
CID 38051144
N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-1-(oxolan-3-yl)methanamine
CID 45198325
1-(3-bromophenyl)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]methanamine
CID 55684100
N-[(2-ethylsulfanylpyrimidin-5-yl)methyl]-1-(2-morpholin-4-yl-3-pyridinyl)methanamine
CID 26336284
1-[2-(methoxymethyl)phenyl]-3-[(2-morpholin-4-yl-3-pyridinyl)methyl]urea
CID 55704978
1-ethyl-3-(3-methoxypropyl)-2-[(2-morpholin-4-yl-3-pyridinyl)methyl]guanidine;hydroiodide
CID 110973248
1-ethyl-3-[(2-morpholin-4-yl-3-pyridinyl)methyl]urea
CID 47226420

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]ethanamine?
The IUPAC name of 2-methoxy-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]ethanamine (CID 114056606) is 2-methoxy-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]ethanamine.
What is the SMILES notation for 2-methoxy-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]ethanamine?
The canonical SMILES for 2-methoxy-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]ethanamine is COCCNCc1cccnc1N1CCOCC1.
What is the InChIKey of 2-methoxy-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]ethanamine?
The InChIKey is OVWHAMFSFOHRPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O2/c1-17-8-5-14-11-12-3-2-4-15-13(12)16-6-9-18-10-7-16/h2-4,14H,5-11H2,1H3.
What are the key properties of 2-methoxy-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]ethanamine?
2-methoxy-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]ethanamine has a molecular weight of 251.33 g/mol, XLogP of 0.65, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]ethanamine is sourced from PubChem (CID 114056606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).