N,N-dimethylformamide;formamide;oxolane

C8H18N2O3 — CID 88689078

IUPACN,N-dimethylformamide;formamide;oxolane
SMILESC1CCOC1.CN(C)C=O.NC=O
InChIInChI=1S/C4H8O.C3H7NO.CH3NO/c1-2-4-5-3-1;1-4(2)3-5;2-1-3/h1-4H2;3H,1-2H3;1H,(H2,2,3)
InChIKeyUFQKSYRNQRCYDM-UHFFFAOYSA-N
MW190.24 g/mol
LogP-0.40
Rot. Bonds1

About N,N-dimethylformamide;formamide;oxolane

N,N-dimethylformamide;formamide;oxolane (PubChem CID 88689078) has the molecular formula C8H18N2O3 and a molecular weight of 190.24 g/mol. Its IUPAC name is N,N-dimethylformamide;formamide;oxolane.

Molecular Properties

Compound NameN,N-dimethylformamide;formamide;oxolane
PubChem CID88689078
Molecular FormulaC8H18N2O3
Molecular Weight190.24 g/mol
Exact Mass190.13
IUPAC NameN,N-dimethylformamide;formamide;oxolane
SMILESC1CCOC1.CN(C)C=O.NC=O
InChIInChI=1S/C4H8O.C3H7NO.CH3NO/c1-2-4-5-3-1;1-4(2)3-5;2-1-3/h1-4H2;3H,1-2H3;1H,(H2,2,3)
InChIKeyUFQKSYRNQRCYDM-UHFFFAOYSA-N
XLogP-0.40
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.24
LogP ≤ 5-0.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

CID 159352431
CID 159352431
pentakis(N,N-dimethylformamide);ethane
CID 54023735
1,6,11,16,21,26,31-heptaoxacyclopentatriacontane
CID 15446455
N-[bis(dimethylamino)phosphoryl]-N-methylmethanamine;oxolane
CID 86583969
1,6,11,16,21,26,31,36,41,46-decaoxacyclopentacontane
CID 15446458
N,N-dimethylformamide;1,3,2,4-dioxadithietane 2,2,4,4-tetraoxide;1,4-dioxane;sulfuric acid
CID 173435018
formaldehyde;oxolane
CID 174849713
N,N-dimethylformamide;gold;hydrochloride
CID 174891065
hydrazine;oxolane;hydrate
CID 159543883
potassium;N,N-dimethylformamide;iodide
CID 87701364
N,N-dimethylformamide;oxonickel
CID 175038088
oxolane;propan-2-one
CID 22559816

Frequently Asked Questions

What is the IUPAC name of N,N-dimethylformamide;formamide;oxolane?
The IUPAC name of N,N-dimethylformamide;formamide;oxolane (CID 88689078) is N,N-dimethylformamide;formamide;oxolane.
What is the SMILES notation for N,N-dimethylformamide;formamide;oxolane?
The canonical SMILES for N,N-dimethylformamide;formamide;oxolane is C1CCOC1.CN(C)C=O.NC=O.
What is the InChIKey of N,N-dimethylformamide;formamide;oxolane?
The InChIKey is UFQKSYRNQRCYDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8O.C3H7NO.CH3NO/c1-2-4-5-3-1;1-4(2)3-5;2-1-3/h1-4H2;3H,1-2H3;1H,(H2,2,3).
What are the key properties of N,N-dimethylformamide;formamide;oxolane?
N,N-dimethylformamide;formamide;oxolane has a molecular weight of 190.24 g/mol, XLogP of -0.40, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylformamide;formamide;oxolane is sourced from PubChem (CID 88689078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).