N-methyl-1-(2-methyloxolan-3-yl)-3-(oxolan-2-yl)propan-1-amine

C13H25NO2 — CID 104993513

IUPACN-methyl-1-(2-methyloxolan-3-yl)-3-(oxolan-2-yl)propan-1-amine
SMILESCNC(CCC1CCCO1)C1CCOC1C
InChIInChI=1S/C13H25NO2/c1-10-12(7-9-15-10)13(14-2)6-5-11-4-3-8-16-11/h10-14H,3-9H2,1-2H3
InChIKeyUVASXTPQQOXRTE-UHFFFAOYSA-N
MW227.35 g/mol
LogP1.96
Rot. Bonds5

About N-methyl-1-(2-methyloxolan-3-yl)-3-(oxolan-2-yl)propan-1-amine

N-methyl-1-(2-methyloxolan-3-yl)-3-(oxolan-2-yl)propan-1-amine (PubChem CID 104993513) has the molecular formula C13H25NO2 and a molecular weight of 227.35 g/mol. Its IUPAC name is N-methyl-1-(2-methyloxolan-3-yl)-3-(oxolan-2-yl)propan-1-amine.

Molecular Properties

Compound NameN-methyl-1-(2-methyloxolan-3-yl)-3-(oxolan-2-yl)propan-1-amine
PubChem CID104993513
Molecular FormulaC13H25NO2
Molecular Weight227.35 g/mol
Exact Mass227.19
IUPAC NameN-methyl-1-(2-methyloxolan-3-yl)-3-(oxolan-2-yl)propan-1-amine
SMILESCNC(CCC1CCCO1)C1CCOC1C
InChIInChI=1S/C13H25NO2/c1-10-12(7-9-15-10)13(14-2)6-5-11-4-3-8-16-11/h10-14H,3-9H2,1-2H3
InChIKeyUVASXTPQQOXRTE-UHFFFAOYSA-N
XLogP1.96
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-methyl-1-(2-methyloxolan-3-yl)-3-(oxolan-2-yl)propan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2-bicyclo[2.2.1]heptanyl)-N-methyl-3-(oxolan-2-yl)propan-1-amine
CID 113383516
N-methyl-1-(5-methyloxolan-2-yl)-3-(oxolan-2-yl)propan-1-amine
CID 104993527
N-methyl-1-(3-methylcyclohexyl)-3-(oxolan-2-yl)propan-1-amine
CID 65164399
N-methyl-1-(2-methyloxolan-3-yl)hexan-1-amine
CID 115837016
N,4-dimethyl-1-(oxolan-2-yl)pentan-3-amine
CID 62549646
1-cyclobutyl-N-methyl-4-(oxolan-2-yl)butan-1-amine
CID 65164623
4-ethylsulfonyl-N-methyl-1-(2-methyloxolan-3-yl)butan-1-amine
CID 115865167
1-(4-ethylcyclohexyl)-N-methyl-3-(oxan-2-yl)propan-1-amine
CID 104991042
N-methyl-1-(1-methylcyclohexyl)-3-(oxolan-2-yl)propan-1-amine
CID 106830218
N-methyl-1-(2-methyloxolan-3-yl)-3-phenylpropan-1-amine
CID 115793579
[1-cycloheptyl-3-(oxolan-2-yl)propyl]hydrazine
CID 105231964
N-methyl-1-(3-methylcyclopentyl)-4-(oxolan-2-yl)butan-1-amine
CID 65413363

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-methyloxolan-3-yl)-3-(oxolan-2-yl)propan-1-amine?
The IUPAC name of N-methyl-1-(2-methyloxolan-3-yl)-3-(oxolan-2-yl)propan-1-amine (CID 104993513) is N-methyl-1-(2-methyloxolan-3-yl)-3-(oxolan-2-yl)propan-1-amine.
What is the SMILES notation for N-methyl-1-(2-methyloxolan-3-yl)-3-(oxolan-2-yl)propan-1-amine?
The canonical SMILES for N-methyl-1-(2-methyloxolan-3-yl)-3-(oxolan-2-yl)propan-1-amine is CNC(CCC1CCCO1)C1CCOC1C.
What is the InChIKey of N-methyl-1-(2-methyloxolan-3-yl)-3-(oxolan-2-yl)propan-1-amine?
The InChIKey is UVASXTPQQOXRTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO2/c1-10-12(7-9-15-10)13(14-2)6-5-11-4-3-8-16-11/h10-14H,3-9H2,1-2H3.
What are the key properties of N-methyl-1-(2-methyloxolan-3-yl)-3-(oxolan-2-yl)propan-1-amine?
N-methyl-1-(2-methyloxolan-3-yl)-3-(oxolan-2-yl)propan-1-amine has a molecular weight of 227.35 g/mol, XLogP of 1.96, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-methyloxolan-3-yl)-3-(oxolan-2-yl)propan-1-amine is sourced from PubChem (CID 104993513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).