N,N-diethylethanamine;thiophene

C10H19NS — CID 159536832

IUPACN,N-diethylethanamine;thiophene
SMILESCCN(CC)CC.c1ccsc1
InChIInChI=1S/C6H15N.C4H4S/c1-4-7(5-2)6-3;1-2-4-5-3-1/h4-6H2,1-3H3;1-4H
InChIKeyMDRVQGBVZPRNIL-UHFFFAOYSA-N
MW185.34 g/mol
LogP3.10
Rot. Bonds3

About N,N-diethylethanamine;thiophene

N,N-diethylethanamine;thiophene (PubChem CID 159536832) has the molecular formula C10H19NS and a molecular weight of 185.34 g/mol. Its IUPAC name is N,N-diethylethanamine;thiophene.

Molecular Properties

Compound NameN,N-diethylethanamine;thiophene
PubChem CID159536832
Molecular FormulaC10H19NS
Molecular Weight185.34 g/mol
Exact Mass185.12
IUPAC NameN,N-diethylethanamine;thiophene
SMILESCCN(CC)CC.c1ccsc1
InChIInChI=1S/C6H15N.C4H4S/c1-4-7(5-2)6-3;1-2-4-5-3-1/h4-6H2,1-3H3;1-4H
InChIKeyMDRVQGBVZPRNIL-UHFFFAOYSA-N
XLogP3.10
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.34
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-diethylethanamine;thiophene?
The IUPAC name of N,N-diethylethanamine;thiophene (CID 159536832) is N,N-diethylethanamine;thiophene.
What is the SMILES notation for N,N-diethylethanamine;thiophene?
The canonical SMILES for N,N-diethylethanamine;thiophene is CCN(CC)CC.c1ccsc1.
What is the InChIKey of N,N-diethylethanamine;thiophene?
The InChIKey is MDRVQGBVZPRNIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15N.C4H4S/c1-4-7(5-2)6-3;1-2-4-5-3-1/h4-6H2,1-3H3;1-4H.
What are the key properties of N,N-diethylethanamine;thiophene?
N,N-diethylethanamine;thiophene has a molecular weight of 185.34 g/mol, XLogP of 3.10, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethylethanamine;thiophene is sourced from PubChem (CID 159536832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).