5-[6-[4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]-3-pyridinyl]pyridin-2-amine

C25H30N4O2 — CID 127250428

IUPAC5-[6-[4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]-3-pyridinyl]pyridin-2-amine
SMILESCOc1cc(C)c(CN2CCOC(c3ccc(-c4ccc(N)nc4)cn3)C2)c(C)c1C
InChIInChI=1S/C25H30N4O2/c1-16-11-23(30-4)18(3)17(2)21(16)14-29-9-10-31-24(15-29)22-7-5-19(12-27-22)20-6-8-25(26)28-13-20/h5-8,11-13,24H,9-10,14-15H2,1-4H3,(H2,26,28)
InChIKeyGNBRRVSKLQLGPT-UHFFFAOYSA-N
MW418.54 g/mol
LogP4.23
Rot. Bonds5

About 5-[6-[4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]-3-pyridinyl]pyridin-2-amine

5-[6-[4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]-3-pyridinyl]pyridin-2-amine (PubChem CID 127250428) has the molecular formula C25H30N4O2 and a molecular weight of 418.54 g/mol. Its IUPAC name is 5-[6-[4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]-3-pyridinyl]pyridin-2-amine.

Molecular Properties

Compound Name5-[6-[4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]-3-pyridinyl]pyridin-2-amine
PubChem CID127250428
Molecular FormulaC25H30N4O2
Molecular Weight418.54 g/mol
Exact Mass418.24
IUPAC Name5-[6-[4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]-3-pyridinyl]pyridin-2-amine
SMILESCOc1cc(C)c(CN2CCOC(c3ccc(-c4ccc(N)nc4)cn3)C2)c(C)c1C
InChIInChI=1S/C25H30N4O2/c1-16-11-23(30-4)18(3)17(2)21(16)14-29-9-10-31-24(15-29)22-7-5-19(12-27-22)20-6-8-25(26)28-13-20/h5-8,11-13,24H,9-10,14-15H2,1-4H3,(H2,26,28)
InChIKeyGNBRRVSKLQLGPT-UHFFFAOYSA-N
XLogP4.23
TPSA73.50 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.54
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5-[6-[4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]-3-pyridinyl]pyridin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[6-[(2S)-4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]-2-pyridinyl]benzamide
CID 124940397
3-[6-[4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]-2-pyridinyl]benzamide
CID 127250616
3-[6-[(3R)-1-[(4-methoxy-2,3,6-trimethylphenyl)methyl]piperidin-3-yl]-3-pyridinyl]benzamide
CID 125005203
N-(1,5-dimethylpyrazol-3-yl)-6-[(2R)-4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]pyridin-2-amine
CID 125005462
4-[(4-fluorophenyl)methyl]-2-[5-(3-methoxyphenyl)-2-pyridinyl]morpholine
CID 127250272
4-[(2,3-dimethoxyphenyl)methyl]-2-(6-fluoroisoquinolin-3-yl)morpholine
CID 110218665
(2R)-4-[(2,3-dimethoxyphenyl)methyl]-2-(6-fluoroisoquinolin-3-yl)morpholine
CID 92600896
N-[1-[(4-methoxy-2,3,6-trimethylphenyl)methyl]piperidin-3-yl]acetamide
CID 77080451
2-isoquinolin-3-yl-4-[(2-methoxyphenyl)methyl]morpholine
CID 110218627
2-[2-[4-(6-amino-3-pyridinyl)-6-methyl-2-pyridinyl]morpholin-4-yl]-N-cyclohexyl-N-methylacetamide
CID 127251351
2-[(2S)-2-[4-(6-amino-3-pyridinyl)-6-methyl-2-pyridinyl]morpholin-4-yl]-N-cyclohexyl-N-methylacetamide
CID 125015003
(2S)-4-[(2-methoxynaphthalen-1-yl)methyl]-2-pyrazin-2-ylmorpholine
CID 124954317

Frequently Asked Questions

What is the IUPAC name of 5-[6-[4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]-3-pyridinyl]pyridin-2-amine?
The IUPAC name of 5-[6-[4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]-3-pyridinyl]pyridin-2-amine (CID 127250428) is 5-[6-[4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]-3-pyridinyl]pyridin-2-amine.
What is the SMILES notation for 5-[6-[4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]-3-pyridinyl]pyridin-2-amine?
The canonical SMILES for 5-[6-[4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]-3-pyridinyl]pyridin-2-amine is COc1cc(C)c(CN2CCOC(c3ccc(-c4ccc(N)nc4)cn3)C2)c(C)c1C.
What is the InChIKey of 5-[6-[4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]-3-pyridinyl]pyridin-2-amine?
The InChIKey is GNBRRVSKLQLGPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H30N4O2/c1-16-11-23(30-4)18(3)17(2)21(16)14-29-9-10-31-24(15-29)22-7-5-19(12-27-22)20-6-8-25(26)28-13-20/h5-8,11-13,24H,9-10,14-15H2,1-4H3,(H2,26,28).
What are the key properties of 5-[6-[4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]-3-pyridinyl]pyridin-2-amine?
5-[6-[4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]-3-pyridinyl]pyridin-2-amine has a molecular weight of 418.54 g/mol, XLogP of 4.23, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[6-[4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]-3-pyridinyl]pyridin-2-amine is sourced from PubChem (CID 127250428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).