N,N-dimethyl-2-(oxolan-3-yl)ethanimidamide

C8H16N2O — CID 103988079

IUPACN,N-dimethyl-2-(oxolan-3-yl)ethanimidamide
SMILES[H]/N=C(/CC1CCOC1)N(C)C
InChIInChI=1S/C8H16N2O/c1-10(2)8(9)5-7-3-4-11-6-7/h7,9H,3-6H2,1-2H3/b9-8-
InChIKeyLGWOZQQXYYAUEG-HJWRWDBZSA-N
MW156.23 g/mol
LogP0.95
Rot. Bonds2

About N,N-dimethyl-2-(oxolan-3-yl)ethanimidamide

N,N-dimethyl-2-(oxolan-3-yl)ethanimidamide (PubChem CID 103988079) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is N,N-dimethyl-2-(oxolan-3-yl)ethanimidamide.

Molecular Properties

Compound NameN,N-dimethyl-2-(oxolan-3-yl)ethanimidamide
PubChem CID103988079
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC NameN,N-dimethyl-2-(oxolan-3-yl)ethanimidamide
SMILES[H]/N=C(/CC1CCOC1)N(C)C
InChIInChI=1S/C8H16N2O/c1-10(2)8(9)5-7-3-4-11-6-7/h7,9H,3-6H2,1-2H3/b9-8-
InChIKeyLGWOZQQXYYAUEG-HJWRWDBZSA-N
XLogP0.95
TPSA36.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

N-methyl-N-(oxolan-3-ylmethyl)ethanimidamide
CID 130942452
N-methyl-N-(oxan-3-ylmethyl)ethanimidamide
CID 63707795
N,N-diethyloxolane-3-carboximidamide
CID 65329829
1-(oxan-4-yl)-3-(oxolan-3-yl)propan-2-one
CID 103986313
3-ethyloxolane
CID 10996972
3-(bromomethyl)oxolane
CID 14173422
2,2-difluoro-N-methyl-2-nitro-N-(oxolan-3-ylmethyl)ethanimidamide
CID 139694550
N-methyl-N-(oxolan-3-ylmethyl)acetamide
CID 129016783
N-methyl-2-(oxolan-3-yl)-N-pyrrolidin-3-ylacetamide
CID 119551379
N,2-dimethyl-N-(oxan-3-ylmethyl)propanimidamide
CID 63707794
1-(oxolan-3-ylmethyl)cyclobutan-1-ol
CID 115073595
N'-hydroxy-2-(oxolan-3-yl)ethanimidamide
CID 109375750

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(oxolan-3-yl)ethanimidamide?
The IUPAC name of N,N-dimethyl-2-(oxolan-3-yl)ethanimidamide (CID 103988079) is N,N-dimethyl-2-(oxolan-3-yl)ethanimidamide.
What is the SMILES notation for N,N-dimethyl-2-(oxolan-3-yl)ethanimidamide?
The canonical SMILES for N,N-dimethyl-2-(oxolan-3-yl)ethanimidamide is [H]/N=C(/CC1CCOC1)N(C)C.
What is the InChIKey of N,N-dimethyl-2-(oxolan-3-yl)ethanimidamide?
The InChIKey is LGWOZQQXYYAUEG-HJWRWDBZSA-N. The full InChI is InChI=1S/C8H16N2O/c1-10(2)8(9)5-7-3-4-11-6-7/h7,9H,3-6H2,1-2H3/b9-8-.
What are the key properties of N,N-dimethyl-2-(oxolan-3-yl)ethanimidamide?
N,N-dimethyl-2-(oxolan-3-yl)ethanimidamide has a molecular weight of 156.23 g/mol, XLogP of 0.95, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(oxolan-3-yl)ethanimidamide is sourced from PubChem (CID 103988079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).