2,2-dimethyl-N-(2-propyloxan-4-yl)oxan-4-amine

C15H29NO2 — CID 83032687

IUPAC2,2-dimethyl-N-(2-propyloxan-4-yl)oxan-4-amine
SMILESCCCC1CC(NC2CCOC(C)(C)C2)CCO1
InChIInChI=1S/C15H29NO2/c1-4-5-14-10-12(6-8-17-14)16-13-7-9-18-15(2,3)11-13/h12-14,16H,4-11H2,1-3H3
InChIKeyHWLMBQWNDWGBCP-UHFFFAOYSA-N
MW255.40 g/mol
LogP2.88
Rot. Bonds4

About 2,2-dimethyl-N-(2-propyloxan-4-yl)oxan-4-amine

2,2-dimethyl-N-(2-propyloxan-4-yl)oxan-4-amine (PubChem CID 83032687) has the molecular formula C15H29NO2 and a molecular weight of 255.40 g/mol. Its IUPAC name is 2,2-dimethyl-N-(2-propyloxan-4-yl)oxan-4-amine.

Molecular Properties

Compound Name2,2-dimethyl-N-(2-propyloxan-4-yl)oxan-4-amine
PubChem CID83032687
Molecular FormulaC15H29NO2
Molecular Weight255.40 g/mol
Exact Mass255.22
IUPAC Name2,2-dimethyl-N-(2-propyloxan-4-yl)oxan-4-amine
SMILESCCCC1CC(NC2CCOC(C)(C)C2)CCO1
InChIInChI=1S/C15H29NO2/c1-4-5-14-10-12(6-8-17-14)16-13-7-9-18-15(2,3)11-13/h12-14,16H,4-11H2,1-3H3
InChIKeyHWLMBQWNDWGBCP-UHFFFAOYSA-N
XLogP2.88
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.40
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2,2-dimethylcyclopropyl)methyl]-2-propyloxan-4-amine
CID 103991250
N-(2,6-dimethyloxan-4-yl)-2,2-dimethyloxan-4-amine
CID 83033712
4,4-dimethyl-1-[[(2-propyloxan-4-yl)amino]methyl]cyclohexan-1-ol
CID 65115439
2-ethyl-N-(3-methylcyclopentyl)oxan-4-amine
CID 114543810
N-(2,2-dimethyloxan-4-yl)-1,4-dioxaspiro[4.5]decan-8-amine
CID 83033541
N-(3-methyl-2-propan-2-ylbutyl)-2-propyloxan-4-amine
CID 102904715
2,6-dimethyl-N-(2-propyloxan-4-yl)piperidin-1-amine
CID 83007696
N-[(1-methoxycyclobutyl)methyl]-2-propyloxan-4-amine
CID 113362714
N-[(1-methylpyrrolidin-2-yl)methyl]-2-propyloxan-4-amine
CID 103991074
N-(4-propylcyclohexyl)-5-oxaspiro[3.5]nonan-8-amine
CID 79895018
6-[(2-propyloxan-4-yl)amino]hexan-1-ol
CID 103991516
N-(2,2-dimethyloxan-4-yl)butanamide
CID 115563895

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-(2-propyloxan-4-yl)oxan-4-amine?
The IUPAC name of 2,2-dimethyl-N-(2-propyloxan-4-yl)oxan-4-amine (CID 83032687) is 2,2-dimethyl-N-(2-propyloxan-4-yl)oxan-4-amine.
What is the SMILES notation for 2,2-dimethyl-N-(2-propyloxan-4-yl)oxan-4-amine?
The canonical SMILES for 2,2-dimethyl-N-(2-propyloxan-4-yl)oxan-4-amine is CCCC1CC(NC2CCOC(C)(C)C2)CCO1.
What is the InChIKey of 2,2-dimethyl-N-(2-propyloxan-4-yl)oxan-4-amine?
The InChIKey is HWLMBQWNDWGBCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO2/c1-4-5-14-10-12(6-8-17-14)16-13-7-9-18-15(2,3)11-13/h12-14,16H,4-11H2,1-3H3.
What are the key properties of 2,2-dimethyl-N-(2-propyloxan-4-yl)oxan-4-amine?
2,2-dimethyl-N-(2-propyloxan-4-yl)oxan-4-amine has a molecular weight of 255.40 g/mol, XLogP of 2.88, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-(2-propyloxan-4-yl)oxan-4-amine is sourced from PubChem (CID 83032687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).