N-ethyl-1-(5-ethylthiophen-2-yl)-2-methylpentan-1-amine

C14H25NS — CID 43488382

IUPACN-ethyl-1-(5-ethylthiophen-2-yl)-2-methylpentan-1-amine
SMILESCCCC(C)C(NCC)c1ccc(CC)s1
InChIInChI=1S/C14H25NS/c1-5-8-11(4)14(15-7-3)13-10-9-12(6-2)16-13/h9-11,14-15H,5-8H2,1-4H3
InChIKeyMSCRNTMVCMXEFP-UHFFFAOYSA-N
MW239.43 g/mol
LogP4.40
Rot. Bonds7

About N-ethyl-1-(5-ethylthiophen-2-yl)-2-methylpentan-1-amine

N-ethyl-1-(5-ethylthiophen-2-yl)-2-methylpentan-1-amine (PubChem CID 43488382) has the molecular formula C14H25NS and a molecular weight of 239.43 g/mol. Its IUPAC name is N-ethyl-1-(5-ethylthiophen-2-yl)-2-methylpentan-1-amine.

Molecular Properties

Compound NameN-ethyl-1-(5-ethylthiophen-2-yl)-2-methylpentan-1-amine
PubChem CID43488382
Molecular FormulaC14H25NS
Molecular Weight239.43 g/mol
Exact Mass239.17
IUPAC NameN-ethyl-1-(5-ethylthiophen-2-yl)-2-methylpentan-1-amine
SMILESCCCC(C)C(NCC)c1ccc(CC)s1
InChIInChI=1S/C14H25NS/c1-5-8-11(4)14(15-7-3)13-10-9-12(6-2)16-13/h9-11,14-15H,5-8H2,1-4H3
InChIKeyMSCRNTMVCMXEFP-UHFFFAOYSA-N
XLogP4.40
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.43
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-ethyl-1-(5-ethylthiophen-2-yl)-2-methylpentan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(1-chloro-2-methylpentyl)-5-ethylthiophene
CID 63431274
1-(5-ethylthiophen-2-yl)-2-methyl-N-propylpropan-1-amine
CID 43494310
1-(5-ethylthiophen-2-yl)-N-propylbutan-1-amine
CID 43494311
2-ethyl-1-(5-ethylthiophen-2-yl)-N-methylhexan-1-amine
CID 43480735
N-ethyl-1-(5-ethylthiophen-2-yl)ethane-1,2-diamine
CID 62344671
N-ethyl-1-(5-ethylthiophen-2-yl)hexan-3-amine
CID 60996677
N-ethyl-1-(5-ethylthiophen-2-yl)prop-2-en-1-amine
CID 105000886
(1R)-1-(5-ethylthiophen-2-yl)butan-1-amine;hydrochloride
CID 171211735
N-ethyl-1-(3-ethylthiophen-2-yl)-2-methylpentan-1-amine
CID 107893684
(1R)-1-(5-ethylthiophen-2-yl)-N-methylethanamine
CID 55277214
N-ethyl-1-(5-ethylthiophen-2-yl)-3-methylbutan-2-amine
CID 62600764
1-(5-ethylthiophen-2-yl)dodecan-1-ol
CID 65426188

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(5-ethylthiophen-2-yl)-2-methylpentan-1-amine?
The IUPAC name of N-ethyl-1-(5-ethylthiophen-2-yl)-2-methylpentan-1-amine (CID 43488382) is N-ethyl-1-(5-ethylthiophen-2-yl)-2-methylpentan-1-amine.
What is the SMILES notation for N-ethyl-1-(5-ethylthiophen-2-yl)-2-methylpentan-1-amine?
The canonical SMILES for N-ethyl-1-(5-ethylthiophen-2-yl)-2-methylpentan-1-amine is CCCC(C)C(NCC)c1ccc(CC)s1.
What is the InChIKey of N-ethyl-1-(5-ethylthiophen-2-yl)-2-methylpentan-1-amine?
The InChIKey is MSCRNTMVCMXEFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NS/c1-5-8-11(4)14(15-7-3)13-10-9-12(6-2)16-13/h9-11,14-15H,5-8H2,1-4H3.
What are the key properties of N-ethyl-1-(5-ethylthiophen-2-yl)-2-methylpentan-1-amine?
N-ethyl-1-(5-ethylthiophen-2-yl)-2-methylpentan-1-amine has a molecular weight of 239.43 g/mol, XLogP of 4.40, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(5-ethylthiophen-2-yl)-2-methylpentan-1-amine is sourced from PubChem (CID 43488382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).