4-ethyl-N,N-dimethyloxan-2-amine

C9H19NO — CID 176884191

IUPAC4-ethyl-N,N-dimethyloxan-2-amine
SMILESCCC1CCOC(N(C)C)C1
InChIInChI=1S/C9H19NO/c1-4-8-5-6-11-9(7-8)10(2)3/h8-9H,4-7H2,1-3H3
InChIKeyBUFUBDCKEAQYNX-UHFFFAOYSA-N
MW157.26 g/mol
LogP1.71
Rot. Bonds2

About 4-ethyl-N,N-dimethyloxan-2-amine

4-ethyl-N,N-dimethyloxan-2-amine (PubChem CID 176884191) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is 4-ethyl-N,N-dimethyloxan-2-amine.

Molecular Properties

Compound Name4-ethyl-N,N-dimethyloxan-2-amine
PubChem CID176884191
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name4-ethyl-N,N-dimethyloxan-2-amine
SMILESCCC1CCOC(N(C)C)C1
InChIInChI=1S/C9H19NO/c1-4-8-5-6-11-9(7-8)10(2)3/h8-9H,4-7H2,1-3H3
InChIKeyBUFUBDCKEAQYNX-UHFFFAOYSA-N
XLogP1.71
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4-ethyl-N,N-dimethyloxan-2-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

2-N,2-N-dimethyloxane-2,4-diamine;hydrochloride
CID 156905355
4-ethyl-2-[methyl(oxan-4-ylmethyl)amino]cyclohexan-1-ol
CID 63712306
3-ethyloxolane
CID 10996972
1,3-diethylcyclopentane
CID 530396
butane;3-ethyloxolane
CID 143075797
4-ethyl-2-[[methyl(oxolan-2-ylmethyl)amino]methyl]cyclohexan-1-ol
CID 62610434
4-ethyl-2-(oxolan-3-yl)cyclohexan-1-ol
CID 79422205
4-[(E)-pent-2-enyl]oxane
CID 134407828
[(2S,4R)-2-methyloxan-4-yl]methanamine
CID 95335813
(2R,4R)-2-ethyloxan-4-amine
CID 82651052
1-[3-(dimethylamino)azetidin-1-yl]-2-(2-ethyloxan-4-yl)ethanone
CID 167787695
4-ethyl-1-(oxetan-2-yl)piperidine
CID 167509047

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N,N-dimethyloxan-2-amine?
The IUPAC name of 4-ethyl-N,N-dimethyloxan-2-amine (CID 176884191) is 4-ethyl-N,N-dimethyloxan-2-amine.
What is the SMILES notation for 4-ethyl-N,N-dimethyloxan-2-amine?
The canonical SMILES for 4-ethyl-N,N-dimethyloxan-2-amine is CCC1CCOC(N(C)C)C1.
What is the InChIKey of 4-ethyl-N,N-dimethyloxan-2-amine?
The InChIKey is BUFUBDCKEAQYNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-4-8-5-6-11-9(7-8)10(2)3/h8-9H,4-7H2,1-3H3.
What are the key properties of 4-ethyl-N,N-dimethyloxan-2-amine?
4-ethyl-N,N-dimethyloxan-2-amine has a molecular weight of 157.26 g/mol, XLogP of 1.71, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N,N-dimethyloxan-2-amine is sourced from PubChem (CID 176884191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).