3-ethyl-1-(2-methyl-1,3-thiazol-4-yl)-N-propylpentan-1-amine

C14H26N2S — CID 105176678

IUPAC3-ethyl-1-(2-methyl-1,3-thiazol-4-yl)-N-propylpentan-1-amine
SMILESCCCNC(CC(CC)CC)c1csc(C)n1
InChIInChI=1S/C14H26N2S/c1-5-8-15-13(9-12(6-2)7-3)14-10-17-11(4)16-14/h10,12-13,15H,5-9H2,1-4H3
InChIKeyFNBVQTJYYDTIKV-UHFFFAOYSA-N
MW254.44 g/mol
LogP4.32
Rot. Bonds8

About 3-ethyl-1-(2-methyl-1,3-thiazol-4-yl)-N-propylpentan-1-amine

3-ethyl-1-(2-methyl-1,3-thiazol-4-yl)-N-propylpentan-1-amine (PubChem CID 105176678) has the molecular formula C14H26N2S and a molecular weight of 254.44 g/mol. Its IUPAC name is 3-ethyl-1-(2-methyl-1,3-thiazol-4-yl)-N-propylpentan-1-amine.

Molecular Properties

Compound Name3-ethyl-1-(2-methyl-1,3-thiazol-4-yl)-N-propylpentan-1-amine
PubChem CID105176678
Molecular FormulaC14H26N2S
Molecular Weight254.44 g/mol
Exact Mass254.18
IUPAC Name3-ethyl-1-(2-methyl-1,3-thiazol-4-yl)-N-propylpentan-1-amine
SMILESCCCNC(CC(CC)CC)c1csc(C)n1
InChIInChI=1S/C14H26N2S/c1-5-8-15-13(9-12(6-2)7-3)14-10-17-11(4)16-14/h10,12-13,15H,5-9H2,1-4H3
InChIKeyFNBVQTJYYDTIKV-UHFFFAOYSA-N
XLogP4.32
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.44
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-ethyl-1-(2-methyl-1,3-thiazol-4-yl)-N-propylpentan-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

1-(2-methyl-1,3-thiazol-4-yl)-N-propylpropan-1-amine
CID 105078510
1-(2-methyl-1,3-thiazol-4-yl)-N-propylundecan-1-amine
CID 105138128
N-[2-(4-bromophenyl)-1-(2-methyl-1,3-thiazol-4-yl)ethyl]propan-1-amine
CID 105088934
1-(2-methyl-1,3-thiazol-4-yl)-N-propyl-3-thiophen-3-ylpropan-1-amine
CID 105147754
N-[2-(2-bromophenyl)-1-(2-methyl-1,3-thiazol-4-yl)ethyl]propan-1-amine
CID 105087377
N-[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(2-methyl-1,3-thiazol-4-yl)ethyl]propan-1-amine
CID 105174053
N-[2-(3-bromophenyl)-1-(2-methyl-1,3-thiazol-4-yl)ethyl]propan-1-amine
CID 105089526
N-[1-(2-methyl-1,3-thiazol-4-yl)-2-(2-propyl-1,2,4-triazol-3-yl)ethyl]propan-1-amine
CID 105162517
N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]butan-1-amine
CID 43670043
3-ethyl-1-(1-methylimidazol-4-yl)-N-propylpentan-1-amine
CID 107977060
N-methyl-1-(2-methyl-1,3-thiazol-4-yl)pentan-1-amine
CID 105125168
N-[(4-ethylcyclohexyl)-(2-methyl-1,3-thiazol-4-yl)methyl]propan-1-amine
CID 105155197

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-(2-methyl-1,3-thiazol-4-yl)-N-propylpentan-1-amine?
The IUPAC name of 3-ethyl-1-(2-methyl-1,3-thiazol-4-yl)-N-propylpentan-1-amine (CID 105176678) is 3-ethyl-1-(2-methyl-1,3-thiazol-4-yl)-N-propylpentan-1-amine.
What is the SMILES notation for 3-ethyl-1-(2-methyl-1,3-thiazol-4-yl)-N-propylpentan-1-amine?
The canonical SMILES for 3-ethyl-1-(2-methyl-1,3-thiazol-4-yl)-N-propylpentan-1-amine is CCCNC(CC(CC)CC)c1csc(C)n1.
What is the InChIKey of 3-ethyl-1-(2-methyl-1,3-thiazol-4-yl)-N-propylpentan-1-amine?
The InChIKey is FNBVQTJYYDTIKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2S/c1-5-8-15-13(9-12(6-2)7-3)14-10-17-11(4)16-14/h10,12-13,15H,5-9H2,1-4H3.
What are the key properties of 3-ethyl-1-(2-methyl-1,3-thiazol-4-yl)-N-propylpentan-1-amine?
3-ethyl-1-(2-methyl-1,3-thiazol-4-yl)-N-propylpentan-1-amine has a molecular weight of 254.44 g/mol, XLogP of 4.32, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-(2-methyl-1,3-thiazol-4-yl)-N-propylpentan-1-amine is sourced from PubChem (CID 105176678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).