N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-1-methylcyclobutan-1-amine

C11H18N2S — CID 115765694

IUPACN-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-1-methylcyclobutan-1-amine
SMILESCc1nc(C)c(CNC2(C)CCC2)s1
InChIInChI=1S/C11H18N2S/c1-8-10(14-9(2)13-8)7-12-11(3)5-4-6-11/h12H,4-7H2,1-3H3
InChIKeyCWSWKTLDCBQHGJ-UHFFFAOYSA-N
MW210.35 g/mol
LogP2.79
Rot. Bonds3

About N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-1-methylcyclobutan-1-amine

N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-1-methylcyclobutan-1-amine (PubChem CID 115765694) has the molecular formula C11H18N2S and a molecular weight of 210.35 g/mol. Its IUPAC name is N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-1-methylcyclobutan-1-amine.

Molecular Properties

Compound NameN-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-1-methylcyclobutan-1-amine
PubChem CID115765694
Molecular FormulaC11H18N2S
Molecular Weight210.35 g/mol
Exact Mass210.12
IUPAC NameN-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-1-methylcyclobutan-1-amine
SMILESCc1nc(C)c(CNC2(C)CCC2)s1
InChIInChI=1S/C11H18N2S/c1-8-10(14-9(2)13-8)7-12-11(3)5-4-6-11/h12H,4-7H2,1-3H3
InChIKeyCWSWKTLDCBQHGJ-UHFFFAOYSA-N
XLogP2.79
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.35
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-4-methyloxan-4-amine
CID 115758035
[1-[[(2,4-dimethyl-1,3-thiazol-5-yl)methylamino]methyl]cyclohexyl]methanol
CID 112697676
1-amino-N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]cyclohexane-1-carboxamide
CID 119891897
1-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-3-[(1-hydroxycycloheptyl)methyl]urea
CID 111507929
N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-3,3,5,5-tetramethylcyclohexan-1-amine
CID 103965734
1-methyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]cyclobutan-1-amine
CID 115765812
N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]thietan-3-amine
CID 130616420
N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]pentan-1-amine
CID 64539296
1-cyclopentyl-3-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]urea
CID 71795572
N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-1-(4-ethylcyclohexyl)methanamine
CID 64539534
N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-1-(4-methylcyclohexyl)methanamine
CID 64540574
N-[(2,5-dimethylphenyl)methyl]-1-methylcyclobutan-1-amine
CID 115765888

Frequently Asked Questions

What is the IUPAC name of N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-1-methylcyclobutan-1-amine?
The IUPAC name of N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-1-methylcyclobutan-1-amine (CID 115765694) is N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-1-methylcyclobutan-1-amine.
What is the SMILES notation for N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-1-methylcyclobutan-1-amine?
The canonical SMILES for N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-1-methylcyclobutan-1-amine is Cc1nc(C)c(CNC2(C)CCC2)s1.
What is the InChIKey of N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-1-methylcyclobutan-1-amine?
The InChIKey is CWSWKTLDCBQHGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2S/c1-8-10(14-9(2)13-8)7-12-11(3)5-4-6-11/h12H,4-7H2,1-3H3.
What are the key properties of N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-1-methylcyclobutan-1-amine?
N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-1-methylcyclobutan-1-amine has a molecular weight of 210.35 g/mol, XLogP of 2.79, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-1-methylcyclobutan-1-amine is sourced from PubChem (CID 115765694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).