N,N-dimethylpropan-1-amine;ethane;oxolane

C11H27NO — CID 169251401

IUPACN,N-dimethylpropan-1-amine;ethane;oxolane
SMILESC1CCOC1.CC.CCCN(C)C
InChIInChI=1S/C5H13N.C4H8O.C2H6/c1-4-5-6(2)3;1-2-4-5-3-1;1-2/h4-5H2,1-3H3;1-4H2;1-2H3
InChIKeyDVWATRPGRRESNF-UHFFFAOYSA-N
MW189.34 g/mol
LogP2.78
Rot. Bonds2

About N,N-dimethylpropan-1-amine;ethane;oxolane

N,N-dimethylpropan-1-amine;ethane;oxolane (PubChem CID 169251401) has the molecular formula C11H27NO and a molecular weight of 189.34 g/mol. Its IUPAC name is N,N-dimethylpropan-1-amine;ethane;oxolane.

Molecular Properties

Compound NameN,N-dimethylpropan-1-amine;ethane;oxolane
PubChem CID169251401
Molecular FormulaC11H27NO
Molecular Weight189.34 g/mol
Exact Mass189.21
IUPAC NameN,N-dimethylpropan-1-amine;ethane;oxolane
SMILESC1CCOC1.CC.CCCN(C)C
InChIInChI=1S/C5H13N.C4H8O.C2H6/c1-4-5-6(2)3;1-2-4-5-3-1;1-2/h4-5H2,1-3H3;1-4H2;1-2H3
InChIKeyDVWATRPGRRESNF-UHFFFAOYSA-N
XLogP2.78
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.34
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N,N-dimethylpropan-1-amine;ethane;oxolane with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,N-dimethylpropan-1-amine;ethane;oxolane?
The IUPAC name of N,N-dimethylpropan-1-amine;ethane;oxolane (CID 169251401) is N,N-dimethylpropan-1-amine;ethane;oxolane.
What is the SMILES notation for N,N-dimethylpropan-1-amine;ethane;oxolane?
The canonical SMILES for N,N-dimethylpropan-1-amine;ethane;oxolane is C1CCOC1.CC.CCCN(C)C.
What is the InChIKey of N,N-dimethylpropan-1-amine;ethane;oxolane?
The InChIKey is DVWATRPGRRESNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13N.C4H8O.C2H6/c1-4-5-6(2)3;1-2-4-5-3-1;1-2/h4-5H2,1-3H3;1-4H2;1-2H3.
What are the key properties of N,N-dimethylpropan-1-amine;ethane;oxolane?
N,N-dimethylpropan-1-amine;ethane;oxolane has a molecular weight of 189.34 g/mol, XLogP of 2.78, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylpropan-1-amine;ethane;oxolane is sourced from PubChem (CID 169251401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).