[6,6-dimethyl-4-[(3-propylimidazol-4-yl)methyl]morpholin-2-yl]methanol

C14H25N3O2 — CID 114779787

IUPAC[6,6-dimethyl-4-[(3-propylimidazol-4-yl)methyl]morpholin-2-yl]methanol
SMILESCCCn1cncc1CN1CC(CO)OC(C)(C)C1
InChIInChI=1S/C14H25N3O2/c1-4-5-17-11-15-6-12(17)7-16-8-13(9-18)19-14(2,3)10-16/h6,11,13,18H,4-5,7-10H2,1-3H3
InChIKeyPZIFGONLXDVKGU-UHFFFAOYSA-N
MW267.37 g/mol
LogP1.26
Rot. Bonds5

About [6,6-dimethyl-4-[(3-propylimidazol-4-yl)methyl]morpholin-2-yl]methanol

[6,6-dimethyl-4-[(3-propylimidazol-4-yl)methyl]morpholin-2-yl]methanol (PubChem CID 114779787) has the molecular formula C14H25N3O2 and a molecular weight of 267.37 g/mol. Its IUPAC name is [6,6-dimethyl-4-[(3-propylimidazol-4-yl)methyl]morpholin-2-yl]methanol.

Molecular Properties

Compound Name[6,6-dimethyl-4-[(3-propylimidazol-4-yl)methyl]morpholin-2-yl]methanol
PubChem CID114779787
Molecular FormulaC14H25N3O2
Molecular Weight267.37 g/mol
Exact Mass267.19
IUPAC Name[6,6-dimethyl-4-[(3-propylimidazol-4-yl)methyl]morpholin-2-yl]methanol
SMILESCCCn1cncc1CN1CC(CO)OC(C)(C)C1
InChIInChI=1S/C14H25N3O2/c1-4-5-17-11-15-6-12(17)7-16-8-13(9-18)19-14(2,3)10-16/h6,11,13,18H,4-5,7-10H2,1-3H3
InChIKeyPZIFGONLXDVKGU-UHFFFAOYSA-N
XLogP1.26
TPSA50.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[4-[(1-ethylpyrazol-4-yl)methyl]-6,6-dimethylmorpholin-2-yl]methanol
CID 114779993
3-methyl-1-[(3-propylimidazol-4-yl)methyl]pyrrolidin-3-ol
CID 103358037
2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]ethanol
CID 114779184
(6,6-dimethyl-4-octylmorpholin-2-yl)methanol
CID 114779668
1-[(3-propylimidazol-4-yl)methyl]piperidin-3-ol
CID 66154969
[4-[(4-chloro-1,3-dimethylpyrazol-5-yl)methyl]-6,6-dimethylmorpholin-2-yl]methanol
CID 114779943
4-[(3-propylimidazol-4-yl)methyl]morpholine-2-carboxylic acid
CID 66129464
[4-(2-aminoethyl)-6,6-dimethylmorpholin-2-yl]methanol
CID 114776413
3-methyl-1-[(3-propylimidazol-4-yl)methyl]piperazine
CID 66130031
5-[[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]methyl]-1-methylpyrazole-4-carboxylic acid
CID 114777296
5-methyl-1-[(3-propylimidazol-4-yl)methyl]piperidin-3-amine
CID 79987030
N-[[1-[(3-propylimidazol-4-yl)methyl]piperidin-3-yl]methyl]propan-1-amine
CID 66153816

Frequently Asked Questions

What is the IUPAC name of [6,6-dimethyl-4-[(3-propylimidazol-4-yl)methyl]morpholin-2-yl]methanol?
The IUPAC name of [6,6-dimethyl-4-[(3-propylimidazol-4-yl)methyl]morpholin-2-yl]methanol (CID 114779787) is [6,6-dimethyl-4-[(3-propylimidazol-4-yl)methyl]morpholin-2-yl]methanol.
What is the SMILES notation for [6,6-dimethyl-4-[(3-propylimidazol-4-yl)methyl]morpholin-2-yl]methanol?
The canonical SMILES for [6,6-dimethyl-4-[(3-propylimidazol-4-yl)methyl]morpholin-2-yl]methanol is CCCn1cncc1CN1CC(CO)OC(C)(C)C1.
What is the InChIKey of [6,6-dimethyl-4-[(3-propylimidazol-4-yl)methyl]morpholin-2-yl]methanol?
The InChIKey is PZIFGONLXDVKGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O2/c1-4-5-17-11-15-6-12(17)7-16-8-13(9-18)19-14(2,3)10-16/h6,11,13,18H,4-5,7-10H2,1-3H3.
What are the key properties of [6,6-dimethyl-4-[(3-propylimidazol-4-yl)methyl]morpholin-2-yl]methanol?
[6,6-dimethyl-4-[(3-propylimidazol-4-yl)methyl]morpholin-2-yl]methanol has a molecular weight of 267.37 g/mol, XLogP of 1.26, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6,6-dimethyl-4-[(3-propylimidazol-4-yl)methyl]morpholin-2-yl]methanol is sourced from PubChem (CID 114779787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).