phenyl(1,3-thiazol-2-yl)methanamine

C10H10N2S — CID 20773071

IUPACphenyl(1,3-thiazol-2-yl)methanamine
SMILESNC(c1ccccc1)c1nccs1
InChIInChI=1S/C10H10N2S/c11-9(10-12-6-7-13-10)8-4-2-1-3-5-8/h1-7,9H,11H2
InChIKeyRNIPFQCVVHTZST-UHFFFAOYSA-N
MW190.27 g/mol
LogP2.19
Rot. Bonds2

About phenyl(1,3-thiazol-2-yl)methanamine

phenyl(1,3-thiazol-2-yl)methanamine (PubChem CID 20773071) has the molecular formula C10H10N2S and a molecular weight of 190.27 g/mol. Its IUPAC name is phenyl(1,3-thiazol-2-yl)methanamine.

Molecular Properties

Compound Namephenyl(1,3-thiazol-2-yl)methanamine
PubChem CID20773071
Molecular FormulaC10H10N2S
Molecular Weight190.27 g/mol
Exact Mass190.06
IUPAC Namephenyl(1,3-thiazol-2-yl)methanamine
SMILESNC(c1ccccc1)c1nccs1
InChIInChI=1S/C10H10N2S/c11-9(10-12-6-7-13-10)8-4-2-1-3-5-8/h1-7,9H,11H2
InChIKeyRNIPFQCVVHTZST-UHFFFAOYSA-N
XLogP2.19
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.27
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-(1,3-Thiazol-2-yl)phenyl)methanamine
CID 21066395
2-Phenylthiazole
CID 547494
(2-Phenyl-1,3-thiazol-5-yl)methanamine
CID 595758
(2-Phenyl-1,3-thiazol-4-yl)methanamine
CID 736526
(2-Phenyl-1,3-thiazol-5-yl)methanamine hydrochloride
CID 2932203
2-Benzyl-1,3-thiazole
CID 21183829
[3-(1,3-Thiazol-2-YL)phenyl]methylamine
CID 18525727
1-(2-(2-Chlorophenyl)-1-(thiazol-2-yl)ethyl)piperazine
CID 44414810
3-Thiazol-2-yl-3,4-dihydro-isoquinolin-1-ylamine
CID 18785857
N'-[[(3R)-1,2,3,4-tetrahydroisoquinolin-3-yl]methyl]-N'-(1,3-thiazol-2-ylmethyl)butane-1,4-diamine
CID 135314474
(1S)-2-phenyl-N-(1,3-thiazol-2-ylmethyl)cyclopropan-1-amine
CID 68574739
4-(1,3-Thiazol-2-yl)aniline
CID 3474784

Frequently Asked Questions

What is the IUPAC name of phenyl(1,3-thiazol-2-yl)methanamine?
The IUPAC name of phenyl(1,3-thiazol-2-yl)methanamine (CID 20773071) is phenyl(1,3-thiazol-2-yl)methanamine.
What is the SMILES notation for phenyl(1,3-thiazol-2-yl)methanamine?
The canonical SMILES for phenyl(1,3-thiazol-2-yl)methanamine is NC(c1ccccc1)c1nccs1.
What is the InChIKey of phenyl(1,3-thiazol-2-yl)methanamine?
The InChIKey is RNIPFQCVVHTZST-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2S/c11-9(10-12-6-7-13-10)8-4-2-1-3-5-8/h1-7,9H,11H2.
What are the key properties of phenyl(1,3-thiazol-2-yl)methanamine?
phenyl(1,3-thiazol-2-yl)methanamine has a molecular weight of 190.27 g/mol, XLogP of 2.19, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl(1,3-thiazol-2-yl)methanamine is sourced from PubChem (CID 20773071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).