5-N-[[1-(dimethylamino)cyclobutyl]methyl]-5-N-methyl-1,2-thiazole-3,5-diamine

C11H20N4S — CID 103365871

IUPAC5-N-[[1-(dimethylamino)cyclobutyl]methyl]-5-N-methyl-1,2-thiazole-3,5-diamine
SMILESCN(CC1(N(C)C)CCC1)c1cc(N)ns1
InChIInChI=1S/C11H20N4S/c1-14(2)11(5-4-6-11)8-15(3)10-7-9(12)13-16-10/h7H,4-6,8H2,1-3H3,(H2,12,13)
InChIKeyNGFUANHBEIASFX-UHFFFAOYSA-N
MW240.38 g/mol
LogP1.65
Rot. Bonds4

About 5-N-[[1-(dimethylamino)cyclobutyl]methyl]-5-N-methyl-1,2-thiazole-3,5-diamine

5-N-[[1-(dimethylamino)cyclobutyl]methyl]-5-N-methyl-1,2-thiazole-3,5-diamine (PubChem CID 103365871) has the molecular formula C11H20N4S and a molecular weight of 240.38 g/mol. Its IUPAC name is 5-N-[[1-(dimethylamino)cyclobutyl]methyl]-5-N-methyl-1,2-thiazole-3,5-diamine.

Molecular Properties

Compound Name5-N-[[1-(dimethylamino)cyclobutyl]methyl]-5-N-methyl-1,2-thiazole-3,5-diamine
PubChem CID103365871
Molecular FormulaC11H20N4S
Molecular Weight240.38 g/mol
Exact Mass240.14
IUPAC Name5-N-[[1-(dimethylamino)cyclobutyl]methyl]-5-N-methyl-1,2-thiazole-3,5-diamine
SMILESCN(CC1(N(C)C)CCC1)c1cc(N)ns1
InChIInChI=1S/C11H20N4S/c1-14(2)11(5-4-6-11)8-15(3)10-7-9(12)13-16-10/h7H,4-6,8H2,1-3H3,(H2,12,13)
InChIKeyNGFUANHBEIASFX-UHFFFAOYSA-N
XLogP1.65
TPSA45.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.38
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-N-[[1-(dimethylamino)cyclobutyl]methyl]-1,2-thiazole-3,5-diamine
CID 103365933
1-N-[[1-(dimethylamino)cyclobutyl]methyl]-4-iodo-1-N-methylbenzene-1,2-diamine
CID 105414091
methyl 3-amino-5-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-1,2-thiazole-4-carboxylate
CID 103384743
4-N-[[1-(dimethylamino)cyclobutyl]methyl]-4-N-methyl-2-propylpyrimidine-4,6-diamine
CID 105420998
2-N-[[1-(dimethylamino)cyclobutyl]methyl]-2-N,5-dimethylpyridine-2,4-diamine
CID 105414019
ethyl 3-amino-5-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-1,2-thiazole-4-carboxylate
CID 103384742
4-N-[[1-(dimethylamino)cyclobutyl]methyl]-2-(methoxymethyl)-4-N-methylpyrimidine-4,6-diamine
CID 105420936
1-N-[[1-(dimethylamino)cyclobutyl]methyl]-1-N,4-dimethylbenzene-1,2-diamine
CID 105414177
4-N-[[1-(dimethylamino)cyclobutyl]methyl]-4-N-methylpyridine-3,4-diamine
CID 105414086
4-N-[[1-(dimethylamino)cyclobutyl]methyl]-6-ethoxy-4-N-methylpyrimidine-4,5-diamine
CID 105414104
5-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]thiophene-2-carboxylic acid
CID 105415367
5-(aminomethyl)-N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methyl-1,3-thiazol-2-amine
CID 105418253

Frequently Asked Questions

What is the IUPAC name of 5-N-[[1-(dimethylamino)cyclobutyl]methyl]-5-N-methyl-1,2-thiazole-3,5-diamine?
The IUPAC name of 5-N-[[1-(dimethylamino)cyclobutyl]methyl]-5-N-methyl-1,2-thiazole-3,5-diamine (CID 103365871) is 5-N-[[1-(dimethylamino)cyclobutyl]methyl]-5-N-methyl-1,2-thiazole-3,5-diamine.
What is the SMILES notation for 5-N-[[1-(dimethylamino)cyclobutyl]methyl]-5-N-methyl-1,2-thiazole-3,5-diamine?
The canonical SMILES for 5-N-[[1-(dimethylamino)cyclobutyl]methyl]-5-N-methyl-1,2-thiazole-3,5-diamine is CN(CC1(N(C)C)CCC1)c1cc(N)ns1.
What is the InChIKey of 5-N-[[1-(dimethylamino)cyclobutyl]methyl]-5-N-methyl-1,2-thiazole-3,5-diamine?
The InChIKey is NGFUANHBEIASFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4S/c1-14(2)11(5-4-6-11)8-15(3)10-7-9(12)13-16-10/h7H,4-6,8H2,1-3H3,(H2,12,13).
What are the key properties of 5-N-[[1-(dimethylamino)cyclobutyl]methyl]-5-N-methyl-1,2-thiazole-3,5-diamine?
5-N-[[1-(dimethylamino)cyclobutyl]methyl]-5-N-methyl-1,2-thiazole-3,5-diamine has a molecular weight of 240.38 g/mol, XLogP of 1.65, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-[[1-(dimethylamino)cyclobutyl]methyl]-5-N-methyl-1,2-thiazole-3,5-diamine is sourced from PubChem (CID 103365871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).