N-(dimethylamino)-N-ethylformamide

C5H12N2O — CID 54127610

IUPACN-(dimethylamino)-N-ethylformamide
SMILESCCN(C=O)N(C)C
InChIInChI=1S/C5H12N2O/c1-4-7(5-8)6(2)3/h5H,4H2,1-3H3
InChIKeyHSDMIBFUSKWWKQ-UHFFFAOYSA-N
MW116.16 g/mol
LogP-0.06
Rot. Bonds3

About N-(dimethylamino)-N-ethylformamide

N-(dimethylamino)-N-ethylformamide (PubChem CID 54127610) has the molecular formula C5H12N2O and a molecular weight of 116.16 g/mol. Its IUPAC name is N-(dimethylamino)-N-ethylformamide.

Molecular Properties

Compound NameN-(dimethylamino)-N-ethylformamide
PubChem CID54127610
Molecular FormulaC5H12N2O
Molecular Weight116.16 g/mol
Exact Mass116.09
IUPAC NameN-(dimethylamino)-N-ethylformamide
SMILESCCN(C=O)N(C)C
InChIInChI=1S/C5H12N2O/c1-4-7(5-8)6(2)3/h5H,4H2,1-3H3
InChIKeyHSDMIBFUSKWWKQ-UHFFFAOYSA-N
XLogP-0.06
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.16
LogP ≤ 5-0.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-(dimethylamino)-N-ethylformamide 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-(dimethylamino)-N-ethylformamide?
The IUPAC name of N-(dimethylamino)-N-ethylformamide (CID 54127610) is N-(dimethylamino)-N-ethylformamide.
What is the SMILES notation for N-(dimethylamino)-N-ethylformamide?
The canonical SMILES for N-(dimethylamino)-N-ethylformamide is CCN(C=O)N(C)C.
What is the InChIKey of N-(dimethylamino)-N-ethylformamide?
The InChIKey is HSDMIBFUSKWWKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2O/c1-4-7(5-8)6(2)3/h5H,4H2,1-3H3.
What are the key properties of N-(dimethylamino)-N-ethylformamide?
N-(dimethylamino)-N-ethylformamide has a molecular weight of 116.16 g/mol, XLogP of -0.06, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(dimethylamino)-N-ethylformamide is sourced from PubChem (CID 54127610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).