N-ethyl-1-(4-propan-2-yl-1,3-thiazol-2-yl)pentan-1-amine

C13H24N2S — CID 61331622

IUPACN-ethyl-1-(4-propan-2-yl-1,3-thiazol-2-yl)pentan-1-amine
SMILESCCCCC(NCC)c1nc(C(C)C)cs1
InChIInChI=1S/C13H24N2S/c1-5-7-8-11(14-6-2)13-15-12(9-16-13)10(3)4/h9-11,14H,5-8H2,1-4H3
InChIKeyBBGZSBUNBMYVSJ-UHFFFAOYSA-N
MW240.42 g/mol
LogP4.11
Rot. Bonds7

About N-ethyl-1-(4-propan-2-yl-1,3-thiazol-2-yl)pentan-1-amine

N-ethyl-1-(4-propan-2-yl-1,3-thiazol-2-yl)pentan-1-amine (PubChem CID 61331622) has the molecular formula C13H24N2S and a molecular weight of 240.42 g/mol. Its IUPAC name is N-ethyl-1-(4-propan-2-yl-1,3-thiazol-2-yl)pentan-1-amine.

Molecular Properties

Compound NameN-ethyl-1-(4-propan-2-yl-1,3-thiazol-2-yl)pentan-1-amine
PubChem CID61331622
Molecular FormulaC13H24N2S
Molecular Weight240.42 g/mol
Exact Mass240.17
IUPAC NameN-ethyl-1-(4-propan-2-yl-1,3-thiazol-2-yl)pentan-1-amine
SMILESCCCCC(NCC)c1nc(C(C)C)cs1
InChIInChI=1S/C13H24N2S/c1-5-7-8-11(14-6-2)13-15-12(9-16-13)10(3)4/h9-11,14H,5-8H2,1-4H3
InChIKeyBBGZSBUNBMYVSJ-UHFFFAOYSA-N
XLogP4.11
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.42
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-ethyl-1-(4-propan-2-yl-1,3-thiazol-2-yl)pentan-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

N-methyl-1-(4-propan-2-yl-1,3-thiazol-2-yl)octan-1-amine
CID 61330560
1-(4-tert-butyl-1,3-thiazol-2-yl)-N-ethyloctan-1-amine
CID 63405858
N-propan-2-yl-1-(4-propan-2-yl-1,3-thiazol-2-yl)propan-1-amine
CID 61333650
1-(4-propan-2-yl-1,3-thiazol-2-yl)heptan-1-amine
CID 61331075
N-ethyl-2-phenyl-1-(4-propan-2-yl-1,3-thiazol-2-yl)propan-1-amine
CID 61331441
1-(4-tert-butyl-1,3-thiazol-2-yl)-N-ethylbutan-1-amine
CID 61331826
N-methyl-3-methylsulfanyl-1-(4-propan-2-yl-1,3-thiazol-2-yl)propan-1-amine
CID 61331155
2-(3-methylheptan-4-yl)-4-propan-2-yl-1,3-thiazole
CID 123588816
3-ethylsulfanyl-N-propan-2-yl-1-(4-propan-2-yl-1,3-thiazol-2-yl)propan-1-amine
CID 116504477
N-[(2-bromophenyl)-(4-propan-2-yl-1,3-thiazol-2-yl)methyl]ethanamine
CID 61331430
N-ethyl-1-(2-pentan-3-yl-1,3-thiazol-4-yl)ethanamine
CID 64545111
N-ethyl-1-(1,3-thiazol-2-yl)decan-1-amine
CID 114078531

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(4-propan-2-yl-1,3-thiazol-2-yl)pentan-1-amine?
The IUPAC name of N-ethyl-1-(4-propan-2-yl-1,3-thiazol-2-yl)pentan-1-amine (CID 61331622) is N-ethyl-1-(4-propan-2-yl-1,3-thiazol-2-yl)pentan-1-amine.
What is the SMILES notation for N-ethyl-1-(4-propan-2-yl-1,3-thiazol-2-yl)pentan-1-amine?
The canonical SMILES for N-ethyl-1-(4-propan-2-yl-1,3-thiazol-2-yl)pentan-1-amine is CCCCC(NCC)c1nc(C(C)C)cs1.
What is the InChIKey of N-ethyl-1-(4-propan-2-yl-1,3-thiazol-2-yl)pentan-1-amine?
The InChIKey is BBGZSBUNBMYVSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2S/c1-5-7-8-11(14-6-2)13-15-12(9-16-13)10(3)4/h9-11,14H,5-8H2,1-4H3.
What are the key properties of N-ethyl-1-(4-propan-2-yl-1,3-thiazol-2-yl)pentan-1-amine?
N-ethyl-1-(4-propan-2-yl-1,3-thiazol-2-yl)pentan-1-amine has a molecular weight of 240.42 g/mol, XLogP of 4.11, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(4-propan-2-yl-1,3-thiazol-2-yl)pentan-1-amine is sourced from PubChem (CID 61331622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).