(6,6-dimethyl-4-pentan-2-ylmorpholin-2-yl)methanol

C12H25NO2 — CID 107886053

IUPAC(6,6-dimethyl-4-pentan-2-ylmorpholin-2-yl)methanol
SMILESCCCC(C)N1CC(CO)OC(C)(C)C1
InChIInChI=1S/C12H25NO2/c1-5-6-10(2)13-7-11(8-14)15-12(3,4)9-13/h10-11,14H,5-9H2,1-4H3
InChIKeyKYHLZMRTQGJALG-UHFFFAOYSA-N
MW215.34 g/mol
LogP1.65
Rot. Bonds4

About (6,6-dimethyl-4-pentan-2-ylmorpholin-2-yl)methanol

(6,6-dimethyl-4-pentan-2-ylmorpholin-2-yl)methanol (PubChem CID 107886053) has the molecular formula C12H25NO2 and a molecular weight of 215.34 g/mol. Its IUPAC name is (6,6-dimethyl-4-pentan-2-ylmorpholin-2-yl)methanol.

Molecular Properties

Compound Name(6,6-dimethyl-4-pentan-2-ylmorpholin-2-yl)methanol
PubChem CID107886053
Molecular FormulaC12H25NO2
Molecular Weight215.34 g/mol
Exact Mass215.19
IUPAC Name(6,6-dimethyl-4-pentan-2-ylmorpholin-2-yl)methanol
SMILESCCCC(C)N1CC(CO)OC(C)(C)C1
InChIInChI=1S/C12H25NO2/c1-5-6-10(2)13-7-11(8-14)15-12(3,4)9-13/h10-11,14H,5-9H2,1-4H3
InChIKeyKYHLZMRTQGJALG-UHFFFAOYSA-N
XLogP1.65
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(chloromethyl)-2,2-dimethyl-4-pentan-2-ylmorpholine
CID 107887624
N,N-diethyl-2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]propanamide
CID 114779602
methyl 2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]propanoate
CID 114777322
[4-(3-amino-1,1,1-trifluorobutan-2-yl)-6,6-dimethylmorpholin-2-yl]methanol
CID 114776412
2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]propanimidamide
CID 114777135
N'-hydroxy-2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]butanimidamide
CID 104969817
(2R)-1-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]propan-2-ol
CID 106932913
(6,6-dimethyl-4-methylsulfinylmorpholin-2-yl)methanol
CID 130877966
(6,6-dimethyl-4-octylmorpholin-2-yl)methanol
CID 114779668
2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]ethanol
CID 114779184
[4-(2-amino-1-pyridin-4-ylbutyl)-6,6-dimethylmorpholin-2-yl]methanol
CID 114776411
(4-butylsulfonyl-6,6-dimethylmorpholin-2-yl)methanol
CID 114779112

Frequently Asked Questions

What is the IUPAC name of (6,6-dimethyl-4-pentan-2-ylmorpholin-2-yl)methanol?
The IUPAC name of (6,6-dimethyl-4-pentan-2-ylmorpholin-2-yl)methanol (CID 107886053) is (6,6-dimethyl-4-pentan-2-ylmorpholin-2-yl)methanol.
What is the SMILES notation for (6,6-dimethyl-4-pentan-2-ylmorpholin-2-yl)methanol?
The canonical SMILES for (6,6-dimethyl-4-pentan-2-ylmorpholin-2-yl)methanol is CCCC(C)N1CC(CO)OC(C)(C)C1.
What is the InChIKey of (6,6-dimethyl-4-pentan-2-ylmorpholin-2-yl)methanol?
The InChIKey is KYHLZMRTQGJALG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO2/c1-5-6-10(2)13-7-11(8-14)15-12(3,4)9-13/h10-11,14H,5-9H2,1-4H3.
What are the key properties of (6,6-dimethyl-4-pentan-2-ylmorpholin-2-yl)methanol?
(6,6-dimethyl-4-pentan-2-ylmorpholin-2-yl)methanol has a molecular weight of 215.34 g/mol, XLogP of 1.65, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6,6-dimethyl-4-pentan-2-ylmorpholin-2-yl)methanol is sourced from PubChem (CID 107886053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).