N-[(3-methoxyoxolan-3-yl)methyl]-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine

C14H26N2O2S — CID 106285614

IUPACN-[(3-methoxyoxolan-3-yl)methyl]-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine
SMILESCCC(CC)C1CN=C(NCC2(OC)CCOC2)S1
InChIInChI=1S/C14H26N2O2S/c1-4-11(5-2)12-8-15-13(19-12)16-9-14(17-3)6-7-18-10-14/h11-12H,4-10H2,1-3H3,(H,15,16)
InChIKeyGAIMOQFZIZEHTI-UHFFFAOYSA-N
MW286.44 g/mol
LogP2.29
Rot. Bonds6

About N-[(3-methoxyoxolan-3-yl)methyl]-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine

N-[(3-methoxyoxolan-3-yl)methyl]-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 106285614) has the molecular formula C14H26N2O2S and a molecular weight of 286.44 g/mol. Its IUPAC name is N-[(3-methoxyoxolan-3-yl)methyl]-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-[(3-methoxyoxolan-3-yl)methyl]-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID106285614
Molecular FormulaC14H26N2O2S
Molecular Weight286.44 g/mol
Exact Mass286.17
IUPAC NameN-[(3-methoxyoxolan-3-yl)methyl]-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine
SMILESCCC(CC)C1CN=C(NCC2(OC)CCOC2)S1
InChIInChI=1S/C14H26N2O2S/c1-4-11(5-2)12-8-15-13(19-12)16-9-14(17-3)6-7-18-10-14/h11-12H,4-10H2,1-3H3,(H,15,16)
InChIKeyGAIMOQFZIZEHTI-UHFFFAOYSA-N
XLogP2.29
TPSA42.85 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.44
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[(3-methoxyoxolan-3-yl)methyl]-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[(3-methoxyoxolan-3-yl)methyl]-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of N-[(3-methoxyoxolan-3-yl)methyl]-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine (CID 106285614) is N-[(3-methoxyoxolan-3-yl)methyl]-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for N-[(3-methoxyoxolan-3-yl)methyl]-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for N-[(3-methoxyoxolan-3-yl)methyl]-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine is CCC(CC)C1CN=C(NCC2(OC)CCOC2)S1.
What is the InChIKey of N-[(3-methoxyoxolan-3-yl)methyl]-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is GAIMOQFZIZEHTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2S/c1-4-11(5-2)12-8-15-13(19-12)16-9-14(17-3)6-7-18-10-14/h11-12H,4-10H2,1-3H3,(H,15,16).
What are the key properties of N-[(3-methoxyoxolan-3-yl)methyl]-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine?
N-[(3-methoxyoxolan-3-yl)methyl]-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 286.44 g/mol, XLogP of 2.29, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methoxyoxolan-3-yl)methyl]-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 106285614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).