(2R,6R)-2,6-dimethyl-4-[1-[(2,4,5-trimethoxyphenyl)methyl]piperidin-4-yl]morpholine

C21H34N2O4 — CID 6556241

IUPAC(2R,6R)-2,6-dimethyl-4-[1-[(2,4,5-trimethoxyphenyl)methyl]piperidin-4-yl]morpholine
SMILESCOc1cc(OC)c(OC)cc1CN1CCC(N2C[C@@H](C)O[C@H](C)C2)CC1
InChIInChI=1S/C21H34N2O4/c1-15-12-23(13-16(2)27-15)18-6-8-22(9-7-18)14-17-10-20(25-4)21(26-5)11-19(17)24-3/h10-11,15-16,18H,6-9,12-14H2,1-5H3/t15-,16-/m1/s1
InChIKeyYJXDCYFODFWQFP-HZPDHXFCSA-N
MW378.51 g/mol
LogP2.79
Rot. Bonds6

About (2R,6R)-2,6-dimethyl-4-[1-[(2,4,5-trimethoxyphenyl)methyl]piperidin-4-yl]morpholine

(2R,6R)-2,6-dimethyl-4-[1-[(2,4,5-trimethoxyphenyl)methyl]piperidin-4-yl]morpholine (PubChem CID 6556241) has the molecular formula C21H34N2O4 and a molecular weight of 378.51 g/mol. Its IUPAC name is (2R,6R)-2,6-dimethyl-4-[1-[(2,4,5-trimethoxyphenyl)methyl]piperidin-4-yl]morpholine.

Molecular Properties

Compound Name(2R,6R)-2,6-dimethyl-4-[1-[(2,4,5-trimethoxyphenyl)methyl]piperidin-4-yl]morpholine
PubChem CID6556241
Molecular FormulaC21H34N2O4
Molecular Weight378.51 g/mol
Exact Mass378.25
IUPAC Name(2R,6R)-2,6-dimethyl-4-[1-[(2,4,5-trimethoxyphenyl)methyl]piperidin-4-yl]morpholine
SMILESCOc1cc(OC)c(OC)cc1CN1CCC(N2C[C@@H](C)O[C@H](C)C2)CC1
InChIInChI=1S/C21H34N2O4/c1-15-12-23(13-16(2)27-15)18-6-8-22(9-7-18)14-17-10-20(25-4)21(26-5)11-19(17)24-3/h10-11,15-16,18H,6-9,12-14H2,1-5H3/t15-,16-/m1/s1
InChIKeyYJXDCYFODFWQFP-HZPDHXFCSA-N
XLogP2.79
TPSA43.40 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.51
LogP ≤ 52.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze (2R,6R)-2,6-dimethyl-4-[1-[(2,4,5-trimethoxyphenyl)methyl]piperidin-4-yl]morpholine 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

(2R,6R)-4-[1-[(3,4-dimethoxyphenyl)methyl]piperidin-4-yl]-2,6-dimethylmorpholine
CID 756427
(2R,6R)-2,6-dimethyl-4-[1-[(2,4,5-trimethoxyphenyl)methyl]piperidin-1-ium-4-yl]morpholine
CID 6556240
(2S,6S)-4-[1-[(4-methoxy-3-phenylmethoxyphenyl)methyl]piperidin-4-yl]-2,6-dimethylmorpholine
CID 7121801
1-[(1S,3R)-3-methylcyclohexyl]-4-[(2,4,5-trimethoxyphenyl)methyl]piperazine
CID 1131768
2,6-dimethyl-4-[1-[(4-methylphenyl)methyl]piperidin-4-yl]morpholine
CID 3589308
4-[1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-2,6-dimethylmorpholine;oxalic acid
CID 17369761
(2S,6R)-2,6-dimethyl-4-[1-[(3-phenoxyphenyl)methyl]piperidin-4-yl]morpholine
CID 7344375
2,6-dimethyl-4-[1-[(4-methylsulfanylphenyl)methyl]piperidin-4-yl]morpholine
CID 2910746
1-[(1R,2S)-2-methoxycyclohexyl]-4-[(2,4,5-trimethoxyphenyl)methyl]piperazine
CID 1361065
1-[(2,4,5-trimethoxyphenyl)methyl]piperazine;hydrochloride
CID 46736385
4,5-dimethoxy-2-[(4-methylpiperidin-1-yl)methyl]aniline
CID 82183629
1-[(5-bromo-2-methoxyphenyl)methyl]-4-[(3R)-3-methylpiperidin-1-yl]piperidine
CID 1333767

Frequently Asked Questions

What is the IUPAC name of (2R,6R)-2,6-dimethyl-4-[1-[(2,4,5-trimethoxyphenyl)methyl]piperidin-4-yl]morpholine?
The IUPAC name of (2R,6R)-2,6-dimethyl-4-[1-[(2,4,5-trimethoxyphenyl)methyl]piperidin-4-yl]morpholine (CID 6556241) is (2R,6R)-2,6-dimethyl-4-[1-[(2,4,5-trimethoxyphenyl)methyl]piperidin-4-yl]morpholine.
What is the SMILES notation for (2R,6R)-2,6-dimethyl-4-[1-[(2,4,5-trimethoxyphenyl)methyl]piperidin-4-yl]morpholine?
The canonical SMILES for (2R,6R)-2,6-dimethyl-4-[1-[(2,4,5-trimethoxyphenyl)methyl]piperidin-4-yl]morpholine is COc1cc(OC)c(OC)cc1CN1CCC(N2C[C@@H](C)O[C@H](C)C2)CC1.
What is the InChIKey of (2R,6R)-2,6-dimethyl-4-[1-[(2,4,5-trimethoxyphenyl)methyl]piperidin-4-yl]morpholine?
The InChIKey is YJXDCYFODFWQFP-HZPDHXFCSA-N. The full InChI is InChI=1S/C21H34N2O4/c1-15-12-23(13-16(2)27-15)18-6-8-22(9-7-18)14-17-10-20(25-4)21(26-5)11-19(17)24-3/h10-11,15-16,18H,6-9,12-14H2,1-5H3/t15-,16-/m1/s1.
What are the key properties of (2R,6R)-2,6-dimethyl-4-[1-[(2,4,5-trimethoxyphenyl)methyl]piperidin-4-yl]morpholine?
(2R,6R)-2,6-dimethyl-4-[1-[(2,4,5-trimethoxyphenyl)methyl]piperidin-4-yl]morpholine has a molecular weight of 378.51 g/mol, XLogP of 2.79, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,6R)-2,6-dimethyl-4-[1-[(2,4,5-trimethoxyphenyl)methyl]piperidin-4-yl]morpholine is sourced from PubChem (CID 6556241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).