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

C11H20N2S — CID 58745672

IUPACN-pentan-3-yl-4-propan-2-yl-1,3-thiazol-2-amine
SMILESCCC(CC)Nc1nc(C(C)C)cs1
InChIInChI=1S/C11H20N2S/c1-5-9(6-2)12-11-13-10(7-14-11)8(3)4/h7-9H,5-6H2,1-4H3,(H,12,13)
InChIKeyZRWGRNMNNAJYBB-UHFFFAOYSA-N
MW212.36 g/mol
LogP3.87
Rot. Bonds5

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

N-pentan-3-yl-4-propan-2-yl-1,3-thiazol-2-amine (PubChem CID 58745672) has the molecular formula C11H20N2S and a molecular weight of 212.36 g/mol. Its IUPAC name is N-pentan-3-yl-4-propan-2-yl-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-pentan-3-yl-4-propan-2-yl-1,3-thiazol-2-amine
PubChem CID58745672
Molecular FormulaC11H20N2S
Molecular Weight212.36 g/mol
Exact Mass212.13
IUPAC NameN-pentan-3-yl-4-propan-2-yl-1,3-thiazol-2-amine
SMILESCCC(CC)Nc1nc(C(C)C)cs1
InChIInChI=1S/C11H20N2S/c1-5-9(6-2)12-11-13-10(7-14-11)8(3)4/h7-9H,5-6H2,1-4H3,(H,12,13)
InChIKeyZRWGRNMNNAJYBB-UHFFFAOYSA-N
XLogP3.87
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.36
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-pentan-3-yl-4-propan-2-yl-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

Related Compounds

2-amino-3-methyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)pentanamide
CID 54958530
4-propan-2-yl-N-prop-2-enyl-1,3-thiazol-2-amine
CID 130159162
4-butan-2-yl-N-tert-butyl-1,3-thiazol-2-amine
CID 62941631
(2R)-2-amino-N-(4-propan-2-yl-1,3-thiazol-2-yl)pentanamide
CID 103794300
(2R)-2-amino-N-(4-propan-2-yl-1,3-thiazol-2-yl)propanamide
CID 78973473
N-benzyl-4-propan-2-yl-1,3-thiazol-2-amine
CID 21355599
3-[(4-ethyl-1,3-thiazol-2-yl)amino]pentan-1-ol
CID 115691889
N-propan-2-yl-1-(4-propan-2-yl-1,3-thiazol-2-yl)propan-1-amine
CID 61333650
2-amino-2-[2-(butan-2-ylamino)-1,3-thiazol-4-yl]acetic acid
CID 104527337
(2R)-2-amino-3-methyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)butanamide
CID 79013002
3-phenyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)-2-sulfanylpropanamide
CID 107025328
methyl N-(4-propan-2-yl-1,3-thiazol-2-yl)carbamate
CID 58913263

Frequently Asked Questions

What is the IUPAC name of N-pentan-3-yl-4-propan-2-yl-1,3-thiazol-2-amine?
The IUPAC name of N-pentan-3-yl-4-propan-2-yl-1,3-thiazol-2-amine (CID 58745672) is N-pentan-3-yl-4-propan-2-yl-1,3-thiazol-2-amine.
What is the SMILES notation for N-pentan-3-yl-4-propan-2-yl-1,3-thiazol-2-amine?
The canonical SMILES for N-pentan-3-yl-4-propan-2-yl-1,3-thiazol-2-amine is CCC(CC)Nc1nc(C(C)C)cs1.
What is the InChIKey of N-pentan-3-yl-4-propan-2-yl-1,3-thiazol-2-amine?
The InChIKey is ZRWGRNMNNAJYBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2S/c1-5-9(6-2)12-11-13-10(7-14-11)8(3)4/h7-9H,5-6H2,1-4H3,(H,12,13).
What are the key properties of N-pentan-3-yl-4-propan-2-yl-1,3-thiazol-2-amine?
N-pentan-3-yl-4-propan-2-yl-1,3-thiazol-2-amine has a molecular weight of 212.36 g/mol, XLogP of 3.87, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-pentan-3-yl-4-propan-2-yl-1,3-thiazol-2-amine is sourced from PubChem (CID 58745672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).