1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methylpropan-2-amine

C9H16N2S — CID 64989566

IUPAC1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methylpropan-2-amine
SMILESCNC(C)Cc1nc(C)c(C)s1
InChIInChI=1S/C9H16N2S/c1-6(10-4)5-9-11-7(2)8(3)12-9/h6,10H,5H2,1-4H3
InChIKeyNROVVDMPZCUYDI-UHFFFAOYSA-N
MW184.31 g/mol
LogP1.91
Rot. Bonds3

About 1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methylpropan-2-amine

1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methylpropan-2-amine (PubChem CID 64989566) has the molecular formula C9H16N2S and a molecular weight of 184.31 g/mol. Its IUPAC name is 1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methylpropan-2-amine.

Molecular Properties

Compound Name1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methylpropan-2-amine
PubChem CID64989566
Molecular FormulaC9H16N2S
Molecular Weight184.31 g/mol
Exact Mass184.10
IUPAC Name1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methylpropan-2-amine
SMILESCNC(C)Cc1nc(C)c(C)s1
InChIInChI=1S/C9H16N2S/c1-6(10-4)5-9-11-7(2)8(3)12-9/h6,10H,5H2,1-4H3
InChIKeyNROVVDMPZCUYDI-UHFFFAOYSA-N
XLogP1.91
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.31
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methylmethanamine;dihydrochloride
CID 178190269
2-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methyl-1-phenylethanamine
CID 65168981
4-chloro-N-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]butan-2-amine
CID 83188013
3-[(4,5-dimethyl-1,3-thiazol-2-yl)methylamino]butan-1-ol
CID 83176829
1-(4,5-dimethyl-1,3-thiazol-2-yl)-3-methoxy-N-methylhexan-2-amine
CID 116718790
azane;2-ethyl-4,5-dimethyl-1,3-thiazole
CID 69061774
N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]-3-methylbutan-2-amine
CID 115729046
1-(4,5-dimethyl-1,3-thiazol-2-yl)pentane-2,3-diol
CID 103454583
1-(3-chloro-4-methylthiophen-2-yl)-2-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methylethanamine
CID 103406934
N-[4-(4,5-dimethyl-1,3-thiazol-2-yl)-2,3-dimethylbutyl]cyclopropanamine
CID 81015096
2-(4,5-dimethyl-1,3-thiazol-2-yl)-1-(4-ethylsulfanylphenyl)-N-methylethanamine
CID 106848898
1-(2,5-dimethylphenyl)-3-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methylpropan-2-amine
CID 105019818

Frequently Asked Questions

What is the IUPAC name of 1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methylpropan-2-amine?
The IUPAC name of 1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methylpropan-2-amine (CID 64989566) is 1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methylpropan-2-amine.
What is the SMILES notation for 1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methylpropan-2-amine?
The canonical SMILES for 1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methylpropan-2-amine is CNC(C)Cc1nc(C)c(C)s1.
What is the InChIKey of 1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methylpropan-2-amine?
The InChIKey is NROVVDMPZCUYDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2S/c1-6(10-4)5-9-11-7(2)8(3)12-9/h6,10H,5H2,1-4H3.
What are the key properties of 1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methylpropan-2-amine?
1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methylpropan-2-amine has a molecular weight of 184.31 g/mol, XLogP of 1.91, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methylpropan-2-amine is sourced from PubChem (CID 64989566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).