N,N-dimethylformamide;hydron;chloride

C3H8ClNO — CID 173106817

IUPACN,N-dimethylformamide;hydron;chloride
SMILESCN(C)C=O.[Cl-].[H+]
InChIInChI=1S/C3H7NO.ClH/c1-4(2)3-5;/h3H,1-2H3;1H
InChIKeySAVROPQJUYSBDD-UHFFFAOYSA-N
MW109.56 g/mol
LogP-3.18
Rot. Bonds1

About N,N-dimethylformamide;hydron;chloride

N,N-dimethylformamide;hydron;chloride (PubChem CID 173106817) has the molecular formula C3H8ClNO and a molecular weight of 109.56 g/mol. Its IUPAC name is N,N-dimethylformamide;hydron;chloride.

Molecular Properties

Compound NameN,N-dimethylformamide;hydron;chloride
PubChem CID173106817
Molecular FormulaC3H8ClNO
Molecular Weight109.56 g/mol
Exact Mass109.03
IUPAC NameN,N-dimethylformamide;hydron;chloride
SMILESCN(C)C=O.[Cl-].[H+]
InChIInChI=1S/C3H7NO.ClH/c1-4(2)3-5;/h3H,1-2H3;1H
InChIKeySAVROPQJUYSBDD-UHFFFAOYSA-N
XLogP-3.18
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500109.56
LogP ≤ 5-3.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethylformamide;hydron;chloride?
The IUPAC name of N,N-dimethylformamide;hydron;chloride (CID 173106817) is N,N-dimethylformamide;hydron;chloride.
What is the SMILES notation for N,N-dimethylformamide;hydron;chloride?
The canonical SMILES for N,N-dimethylformamide;hydron;chloride is CN(C)C=O.[Cl-].[H+].
What is the InChIKey of N,N-dimethylformamide;hydron;chloride?
The InChIKey is SAVROPQJUYSBDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7NO.ClH/c1-4(2)3-5;/h3H,1-2H3;1H.
What are the key properties of N,N-dimethylformamide;hydron;chloride?
N,N-dimethylformamide;hydron;chloride has a molecular weight of 109.56 g/mol, XLogP of -3.18, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylformamide;hydron;chloride is sourced from PubChem (CID 173106817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).