N-(2,6-dimethyloxan-4-yl)-2,2-dimethyloxan-4-amine

C14H27NO2 — CID 83033712

IUPACN-(2,6-dimethyloxan-4-yl)-2,2-dimethyloxan-4-amine
SMILESCC1CC(NC2CCOC(C)(C)C2)CC(C)O1
InChIInChI=1S/C14H27NO2/c1-10-7-13(8-11(2)17-10)15-12-5-6-16-14(3,4)9-12/h10-13,15H,5-9H2,1-4H3
InChIKeyJJXORRUIQIKNKM-UHFFFAOYSA-N
MW241.37 g/mol
LogP2.49
Rot. Bonds2

About N-(2,6-dimethyloxan-4-yl)-2,2-dimethyloxan-4-amine

N-(2,6-dimethyloxan-4-yl)-2,2-dimethyloxan-4-amine (PubChem CID 83033712) has the molecular formula C14H27NO2 and a molecular weight of 241.37 g/mol. Its IUPAC name is N-(2,6-dimethyloxan-4-yl)-2,2-dimethyloxan-4-amine.

Molecular Properties

Compound NameN-(2,6-dimethyloxan-4-yl)-2,2-dimethyloxan-4-amine
PubChem CID83033712
Molecular FormulaC14H27NO2
Molecular Weight241.37 g/mol
Exact Mass241.20
IUPAC NameN-(2,6-dimethyloxan-4-yl)-2,2-dimethyloxan-4-amine
SMILESCC1CC(NC2CCOC(C)(C)C2)CC(C)O1
InChIInChI=1S/C14H27NO2/c1-10-7-13(8-11(2)17-10)15-12-5-6-16-14(3,4)9-12/h10-13,15H,5-9H2,1-4H3
InChIKeyJJXORRUIQIKNKM-UHFFFAOYSA-N
XLogP2.49
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.37
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,2-dimethyloxan-4-yl)-1,4-dioxaspiro[4.5]decan-8-amine
CID 83033541
(2S,6S)-N-cyclopropyl-2,6-dimethyloxan-4-amine
CID 97358274
2,2-dimethyl-N-(2-propyloxan-4-yl)oxan-4-amine
CID 83032687
N-(2,2-dimethyloxan-4-yl)-1,2,5-trimethylpiperidin-4-amine
CID 83032693
2,2-dimethyl-N-(2-methylthian-3-yl)oxan-4-amine
CID 83033114
N-(2,2-dimethyloxan-4-yl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine
CID 83033630
N-(2,2-dimethyloxan-4-yl)-1-phenylpiperidin-4-amine
CID 103904738
[2-[(2,2-dimethyloxan-4-yl)amino]cyclohexyl]methanol
CID 106359775
N-(3,5-dimethylcyclohexyl)-2,2-diethyloxan-4-amine
CID 82759904
N-(3,3-dimethylbutan-2-yl)-2,2-dimethyloxan-4-amine
CID 115896330
(2R,5S)-5-[(2,2-dimethyloxan-4-yl)carbamoyl]oxolane-2-carboxylic acid
CID 102945599
3-N-(2,2-dimethyloxan-4-yl)butane-2,3-diamine
CID 130574119

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethyloxan-4-yl)-2,2-dimethyloxan-4-amine?
The IUPAC name of N-(2,6-dimethyloxan-4-yl)-2,2-dimethyloxan-4-amine (CID 83033712) is N-(2,6-dimethyloxan-4-yl)-2,2-dimethyloxan-4-amine.
What is the SMILES notation for N-(2,6-dimethyloxan-4-yl)-2,2-dimethyloxan-4-amine?
The canonical SMILES for N-(2,6-dimethyloxan-4-yl)-2,2-dimethyloxan-4-amine is CC1CC(NC2CCOC(C)(C)C2)CC(C)O1.
What is the InChIKey of N-(2,6-dimethyloxan-4-yl)-2,2-dimethyloxan-4-amine?
The InChIKey is JJXORRUIQIKNKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO2/c1-10-7-13(8-11(2)17-10)15-12-5-6-16-14(3,4)9-12/h10-13,15H,5-9H2,1-4H3.
What are the key properties of N-(2,6-dimethyloxan-4-yl)-2,2-dimethyloxan-4-amine?
N-(2,6-dimethyloxan-4-yl)-2,2-dimethyloxan-4-amine has a molecular weight of 241.37 g/mol, XLogP of 2.49, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethyloxan-4-yl)-2,2-dimethyloxan-4-amine is sourced from PubChem (CID 83033712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).