(2-cyclobutyl-4-ethyl-1,3-thiazol-5-yl)methanamine

C10H16N2S — CID 104840931

IUPAC(2-cyclobutyl-4-ethyl-1,3-thiazol-5-yl)methanamine
SMILESCCc1nc(C2CCC2)sc1CN
InChIInChI=1S/C10H16N2S/c1-2-8-9(6-11)13-10(12-8)7-4-3-5-7/h7H,2-6,11H2,1H3
InChIKeyYJNBPJAPGOXUFH-UHFFFAOYSA-N
MW196.32 g/mol
LogP2.43
Rot. Bonds3

About (2-cyclobutyl-4-ethyl-1,3-thiazol-5-yl)methanamine

(2-cyclobutyl-4-ethyl-1,3-thiazol-5-yl)methanamine (PubChem CID 104840931) has the molecular formula C10H16N2S and a molecular weight of 196.32 g/mol. Its IUPAC name is (2-cyclobutyl-4-ethyl-1,3-thiazol-5-yl)methanamine.

Molecular Properties

Compound Name(2-cyclobutyl-4-ethyl-1,3-thiazol-5-yl)methanamine
PubChem CID104840931
Molecular FormulaC10H16N2S
Molecular Weight196.32 g/mol
Exact Mass196.10
IUPAC Name(2-cyclobutyl-4-ethyl-1,3-thiazol-5-yl)methanamine
SMILESCCc1nc(C2CCC2)sc1CN
InChIInChI=1S/C10H16N2S/c1-2-8-9(6-11)13-10(12-8)7-4-3-5-7/h7H,2-6,11H2,1H3
InChIKeyYJNBPJAPGOXUFH-UHFFFAOYSA-N
XLogP2.43
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.32
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[4-ethyl-2-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-1,3-thiazol-5-yl]methanamine
CID 113459578
(2-cyclohexyl-4-ethyl-1,3-thiazol-5-yl)methanol
CID 82429624
[2-(4-methylcyclohexyl)-4-propyl-1,3-thiazol-5-yl]methanamine
CID 114361233
2-cyclopentyl-4-ethyl-1,3-thiazol-5-amine
CID 62076526
(2-cycloheptyl-4-methyl-1,3-thiazol-5-yl)methanamine
CID 65400000
[2-(oxan-3-yl)-4-propyl-1,3-thiazol-5-yl]methanamine
CID 114361278
1-[4-ethyl-2-(3-ethylcyclohexyl)-1,3-thiazol-5-yl]-N-methylmethanamine
CID 104841091
[2-(3-ethylcyclohexyl)-4-methyl-1,3-thiazol-5-yl]methanamine
CID 65414439
[2-(3,3-difluorocyclohexyl)-4-propyl-1,3-thiazol-5-yl]methanamine
CID 114216484
[2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-4-ethyl-1,3-thiazol-5-yl]methanamine
CID 115562457
[4-propyl-2-(thiolan-2-yl)-1,3-thiazol-5-yl]methanamine
CID 114361282
5-(aminomethyl)-N-(cyclobutylmethyl)-4-ethyl-N-methyl-1,3-thiazol-2-amine
CID 62854241

Frequently Asked Questions

What is the IUPAC name of (2-cyclobutyl-4-ethyl-1,3-thiazol-5-yl)methanamine?
The IUPAC name of (2-cyclobutyl-4-ethyl-1,3-thiazol-5-yl)methanamine (CID 104840931) is (2-cyclobutyl-4-ethyl-1,3-thiazol-5-yl)methanamine.
What is the SMILES notation for (2-cyclobutyl-4-ethyl-1,3-thiazol-5-yl)methanamine?
The canonical SMILES for (2-cyclobutyl-4-ethyl-1,3-thiazol-5-yl)methanamine is CCc1nc(C2CCC2)sc1CN.
What is the InChIKey of (2-cyclobutyl-4-ethyl-1,3-thiazol-5-yl)methanamine?
The InChIKey is YJNBPJAPGOXUFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2S/c1-2-8-9(6-11)13-10(12-8)7-4-3-5-7/h7H,2-6,11H2,1H3.
What are the key properties of (2-cyclobutyl-4-ethyl-1,3-thiazol-5-yl)methanamine?
(2-cyclobutyl-4-ethyl-1,3-thiazol-5-yl)methanamine has a molecular weight of 196.32 g/mol, XLogP of 2.43, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclobutyl-4-ethyl-1,3-thiazol-5-yl)methanamine is sourced from PubChem (CID 104840931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).