5-methoxy-N-methyl-1-(oxolan-3-yl)pentan-2-amine

C11H23NO2 — CID 114856903

IUPAC5-methoxy-N-methyl-1-(oxolan-3-yl)pentan-2-amine
SMILESCNC(CCCOC)CC1CCOC1
InChIInChI=1S/C11H23NO2/c1-12-11(4-3-6-13-2)8-10-5-7-14-9-10/h10-12H,3-9H2,1-2H3
InChIKeyCGMTWFCOJYWWOJ-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.43
Rot. Bonds7

About 5-methoxy-N-methyl-1-(oxolan-3-yl)pentan-2-amine

5-methoxy-N-methyl-1-(oxolan-3-yl)pentan-2-amine (PubChem CID 114856903) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is 5-methoxy-N-methyl-1-(oxolan-3-yl)pentan-2-amine.

Molecular Properties

Compound Name5-methoxy-N-methyl-1-(oxolan-3-yl)pentan-2-amine
PubChem CID114856903
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC Name5-methoxy-N-methyl-1-(oxolan-3-yl)pentan-2-amine
SMILESCNC(CCCOC)CC1CCOC1
InChIInChI=1S/C11H23NO2/c1-12-11(4-3-6-13-2)8-10-5-7-14-9-10/h10-12H,3-9H2,1-2H3
InChIKeyCGMTWFCOJYWWOJ-UHFFFAOYSA-N
XLogP1.43
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-methoxy-N-methyl-1-(thian-4-yl)pentan-2-amine
CID 105190189
N-methyl-4-methylsulfonyl-1-(oxolan-3-yl)butan-2-amine
CID 114982644
1-cyclohexyl-N-methyl-3-(oxolan-3-yl)propan-2-amine
CID 103987113
N-methyl-1-(oxan-4-yl)hexan-2-amine
CID 79404472
N-methyl-1-(oxolan-3-yl)pent-4-en-2-amine
CID 103986920
3-methoxy-N-(oxolan-3-ylmethyl)propan-1-amine
CID 43205123
6-methyl-1-(oxolan-3-yl)-N-propylheptan-2-amine
CID 113362206
N-methyl-1-(oxolan-3-yl)-4-thiophen-2-ylbutan-2-amine
CID 103986936
N-ethyl-1-(oxolan-3-yl)decan-2-amine
CID 103987183
N-ethyl-1-(oxolan-3-yl)dodecan-2-amine
CID 103987333
N-methyl-4-(1-methylpyrazol-4-yl)-1-(oxolan-3-yl)butan-2-amine
CID 103012081
4-(4-methoxyphenyl)-N-methyl-1-(oxan-4-yl)butan-2-amine
CID 115846590

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-N-methyl-1-(oxolan-3-yl)pentan-2-amine?
The IUPAC name of 5-methoxy-N-methyl-1-(oxolan-3-yl)pentan-2-amine (CID 114856903) is 5-methoxy-N-methyl-1-(oxolan-3-yl)pentan-2-amine.
What is the SMILES notation for 5-methoxy-N-methyl-1-(oxolan-3-yl)pentan-2-amine?
The canonical SMILES for 5-methoxy-N-methyl-1-(oxolan-3-yl)pentan-2-amine is CNC(CCCOC)CC1CCOC1.
What is the InChIKey of 5-methoxy-N-methyl-1-(oxolan-3-yl)pentan-2-amine?
The InChIKey is CGMTWFCOJYWWOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-12-11(4-3-6-13-2)8-10-5-7-14-9-10/h10-12H,3-9H2,1-2H3.
What are the key properties of 5-methoxy-N-methyl-1-(oxolan-3-yl)pentan-2-amine?
5-methoxy-N-methyl-1-(oxolan-3-yl)pentan-2-amine has a molecular weight of 201.31 g/mol, XLogP of 1.43, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-N-methyl-1-(oxolan-3-yl)pentan-2-amine is sourced from PubChem (CID 114856903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).