(3-cyclopropylimidazol-4-yl)-(4-propan-2-yl-1,3-thiazol-2-yl)methanamine

C13H18N4S — CID 66142262

IUPAC(3-cyclopropylimidazol-4-yl)-(4-propan-2-yl-1,3-thiazol-2-yl)methanamine
SMILESCC(C)c1csc(C(N)c2cncn2C2CC2)n1
InChIInChI=1S/C13H18N4S/c1-8(2)10-6-18-13(16-10)12(14)11-5-15-7-17(11)9-3-4-9/h5-9,12H,3-4,14H2,1-2H3
InChIKeyUBOIJQCECMBUEW-UHFFFAOYSA-N
MW262.38 g/mol
LogP2.85
Rot. Bonds4

About (3-cyclopropylimidazol-4-yl)-(4-propan-2-yl-1,3-thiazol-2-yl)methanamine

(3-cyclopropylimidazol-4-yl)-(4-propan-2-yl-1,3-thiazol-2-yl)methanamine (PubChem CID 66142262) has the molecular formula C13H18N4S and a molecular weight of 262.38 g/mol. Its IUPAC name is (3-cyclopropylimidazol-4-yl)-(4-propan-2-yl-1,3-thiazol-2-yl)methanamine.

Molecular Properties

Compound Name(3-cyclopropylimidazol-4-yl)-(4-propan-2-yl-1,3-thiazol-2-yl)methanamine
PubChem CID66142262
Molecular FormulaC13H18N4S
Molecular Weight262.38 g/mol
Exact Mass262.13
IUPAC Name(3-cyclopropylimidazol-4-yl)-(4-propan-2-yl-1,3-thiazol-2-yl)methanamine
SMILESCC(C)c1csc(C(N)c2cncn2C2CC2)n1
InChIInChI=1S/C13H18N4S/c1-8(2)10-6-18-13(16-10)12(14)11-5-15-7-17(11)9-3-4-9/h5-9,12H,3-4,14H2,1-2H3
InChIKeyUBOIJQCECMBUEW-UHFFFAOYSA-N
XLogP2.85
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.38
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (3-cyclopropylimidazol-4-yl)-(4-propan-2-yl-1,3-thiazol-2-yl)methanamine 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-[(3-cyclopropylimidazol-4-yl)-(4-propan-2-yl-1,3-thiazol-2-yl)methyl]ethanamine
CID 66140055
(3-ethylimidazol-4-yl)-(4-propan-2-yl-1,3-thiazol-2-yl)methanamine
CID 66134524
(4-propan-2-yl-1,3-thiazol-2-yl)-(3-propylimidazol-4-yl)methanamine
CID 66131032
2-methyl-1-[3-(4-methylcyclohexyl)imidazol-4-yl]propan-1-amine
CID 102969473
(1-ethylpyrazol-4-yl)-(4-propan-2-yl-1,3-thiazol-2-yl)methanamine
CID 103570173
(1R)-1-[3-(4,4-dimethylcyclohexyl)imidazol-4-yl]ethanamine
CID 104943263
1-[3-(1,1-dioxothietan-3-yl)imidazol-4-yl]ethanamine
CID 130921357
4-amino-3-(3-cyclopropylimidazol-4-yl)pentan-1-ol
CID 66140672
N-methyl-1-(3-propan-2-ylimidazol-4-yl)-1-(4-propan-2-yl-1,3-thiazol-2-yl)methanamine
CID 66164220
1-(3-cyclopropylimidazol-4-yl)-2,2,2-trifluoroethanamine
CID 66140665
(1R)-1-[3-(3-methylcyclopentyl)imidazol-4-yl]ethanamine
CID 104943974
(1S)-1-[3-(3-methylcyclopentyl)imidazol-4-yl]ethanamine
CID 104943969

Frequently Asked Questions

What is the IUPAC name of (3-cyclopropylimidazol-4-yl)-(4-propan-2-yl-1,3-thiazol-2-yl)methanamine?
The IUPAC name of (3-cyclopropylimidazol-4-yl)-(4-propan-2-yl-1,3-thiazol-2-yl)methanamine (CID 66142262) is (3-cyclopropylimidazol-4-yl)-(4-propan-2-yl-1,3-thiazol-2-yl)methanamine.
What is the SMILES notation for (3-cyclopropylimidazol-4-yl)-(4-propan-2-yl-1,3-thiazol-2-yl)methanamine?
The canonical SMILES for (3-cyclopropylimidazol-4-yl)-(4-propan-2-yl-1,3-thiazol-2-yl)methanamine is CC(C)c1csc(C(N)c2cncn2C2CC2)n1.
What is the InChIKey of (3-cyclopropylimidazol-4-yl)-(4-propan-2-yl-1,3-thiazol-2-yl)methanamine?
The InChIKey is UBOIJQCECMBUEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4S/c1-8(2)10-6-18-13(16-10)12(14)11-5-15-7-17(11)9-3-4-9/h5-9,12H,3-4,14H2,1-2H3.
What are the key properties of (3-cyclopropylimidazol-4-yl)-(4-propan-2-yl-1,3-thiazol-2-yl)methanamine?
(3-cyclopropylimidazol-4-yl)-(4-propan-2-yl-1,3-thiazol-2-yl)methanamine has a molecular weight of 262.38 g/mol, XLogP of 2.85, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3-cyclopropylimidazol-4-yl)-(4-propan-2-yl-1,3-thiazol-2-yl)methanamine is sourced from PubChem (CID 66142262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).