N-ethyl-N-methylethanamine;thiophene-3-carbaldehyde

C10H17NOS — CID 169135569

IUPACN-ethyl-N-methylethanamine;thiophene-3-carbaldehyde
SMILESCCN(C)CC.O=Cc1ccsc1
InChIInChI=1S/C5H13N.C5H4OS/c1-4-6(3)5-2;6-3-5-1-2-7-4-5/h4-5H2,1-3H3;1-4H
InChIKeyVOQDIPQLACLXPI-UHFFFAOYSA-N
MW199.32 g/mol
LogP2.52
Rot. Bonds3

About N-ethyl-N-methylethanamine;thiophene-3-carbaldehyde

N-ethyl-N-methylethanamine;thiophene-3-carbaldehyde (PubChem CID 169135569) has the molecular formula C10H17NOS and a molecular weight of 199.32 g/mol. Its IUPAC name is N-ethyl-N-methylethanamine;thiophene-3-carbaldehyde.

Molecular Properties

Compound NameN-ethyl-N-methylethanamine;thiophene-3-carbaldehyde
PubChem CID169135569
Molecular FormulaC10H17NOS
Molecular Weight199.32 g/mol
Exact Mass199.10
IUPAC NameN-ethyl-N-methylethanamine;thiophene-3-carbaldehyde
SMILESCCN(C)CC.O=Cc1ccsc1
InChIInChI=1S/C5H13N.C5H4OS/c1-4-6(3)5-2;6-3-5-1-2-7-4-5/h4-5H2,1-3H3;1-4H
InChIKeyVOQDIPQLACLXPI-UHFFFAOYSA-N
XLogP2.52
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.32
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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-ethyl-N-methylethanamine;thiophene-3-carbaldehyde?
The IUPAC name of N-ethyl-N-methylethanamine;thiophene-3-carbaldehyde (CID 169135569) is N-ethyl-N-methylethanamine;thiophene-3-carbaldehyde.
What is the SMILES notation for N-ethyl-N-methylethanamine;thiophene-3-carbaldehyde?
The canonical SMILES for N-ethyl-N-methylethanamine;thiophene-3-carbaldehyde is CCN(C)CC.O=Cc1ccsc1.
What is the InChIKey of N-ethyl-N-methylethanamine;thiophene-3-carbaldehyde?
The InChIKey is VOQDIPQLACLXPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13N.C5H4OS/c1-4-6(3)5-2;6-3-5-1-2-7-4-5/h4-5H2,1-3H3;1-4H.
What are the key properties of N-ethyl-N-methylethanamine;thiophene-3-carbaldehyde?
N-ethyl-N-methylethanamine;thiophene-3-carbaldehyde has a molecular weight of 199.32 g/mol, XLogP of 2.52, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methylethanamine;thiophene-3-carbaldehyde is sourced from PubChem (CID 169135569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).