5-[3-(dimethylamino)pyrrolidin-1-yl]-1,2-thiazol-3-amine

C9H16N4S — CID 103362838

IUPAC5-[3-(dimethylamino)pyrrolidin-1-yl]-1,2-thiazol-3-amine
SMILESCN(C)C1CCN(c2cc(N)ns2)C1
InChIInChI=1S/C9H16N4S/c1-12(2)7-3-4-13(6-7)9-5-8(10)11-14-9/h5,7H,3-4,6H2,1-2H3,(H2,10,11)
InChIKeyOIIIAYKLKVLALH-UHFFFAOYSA-N
MW212.32 g/mol
LogP0.87
Rot. Bonds2

About 5-[3-(dimethylamino)pyrrolidin-1-yl]-1,2-thiazol-3-amine

5-[3-(dimethylamino)pyrrolidin-1-yl]-1,2-thiazol-3-amine (PubChem CID 103362838) has the molecular formula C9H16N4S and a molecular weight of 212.32 g/mol. Its IUPAC name is 5-[3-(dimethylamino)pyrrolidin-1-yl]-1,2-thiazol-3-amine.

Molecular Properties

Compound Name5-[3-(dimethylamino)pyrrolidin-1-yl]-1,2-thiazol-3-amine
PubChem CID103362838
Molecular FormulaC9H16N4S
Molecular Weight212.32 g/mol
Exact Mass212.11
IUPAC Name5-[3-(dimethylamino)pyrrolidin-1-yl]-1,2-thiazol-3-amine
SMILESCN(C)C1CCN(c2cc(N)ns2)C1
InChIInChI=1S/C9H16N4S/c1-12(2)7-3-4-13(6-7)9-5-8(10)11-14-9/h5,7H,3-4,6H2,1-2H3,(H2,10,11)
InChIKeyOIIIAYKLKVLALH-UHFFFAOYSA-N
XLogP0.87
TPSA45.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-(3,5-dimethylpiperidin-1-yl)-1,2-thiazol-3-amine
CID 103362049
5-[4-(trifluoromethyl)piperidin-1-yl]-1,2-thiazol-3-amine
CID 103363237
5-(4-propylazepan-1-yl)-1,2-thiazol-3-amine
CID 103363126
3-amino-5-[3-(dimethylamino)pyrrolidin-1-yl]thiophene-2-carboxamide
CID 103421975
7-(3-amino-1,2-thiazol-5-yl)-1,2,5,6,8,8a-hexahydroimidazo[1,5-a]pyrazin-3-one
CID 103359130
5-[3-(dimethylamino)piperidin-1-yl]-1,2,4-thiadiazol-3-amine
CID 66281219
5-bromo-2-[3-(dimethylamino)pyrrolidin-1-yl]pyridin-3-amine
CID 63164355
6-[3-(dimethylamino)piperidin-1-yl]pyrimidin-4-amine
CID 80856163
1-(3-amino-4-methylphenyl)-N,N-dimethylpyrrolidin-3-amine
CID 63164363
5-(3,3-dimethylpiperidin-1-yl)-1,2-thiazol-3-amine
CID 103363088
1-(2-amino-4-fluorophenyl)-N,N-dimethylpyrrolidin-3-amine
CID 63164395
4-[3-(dimethylamino)pyrrolidin-1-yl]pyrimidin-2-amine
CID 80828220

Frequently Asked Questions

What is the IUPAC name of 5-[3-(dimethylamino)pyrrolidin-1-yl]-1,2-thiazol-3-amine?
The IUPAC name of 5-[3-(dimethylamino)pyrrolidin-1-yl]-1,2-thiazol-3-amine (CID 103362838) is 5-[3-(dimethylamino)pyrrolidin-1-yl]-1,2-thiazol-3-amine.
What is the SMILES notation for 5-[3-(dimethylamino)pyrrolidin-1-yl]-1,2-thiazol-3-amine?
The canonical SMILES for 5-[3-(dimethylamino)pyrrolidin-1-yl]-1,2-thiazol-3-amine is CN(C)C1CCN(c2cc(N)ns2)C1.
What is the InChIKey of 5-[3-(dimethylamino)pyrrolidin-1-yl]-1,2-thiazol-3-amine?
The InChIKey is OIIIAYKLKVLALH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4S/c1-12(2)7-3-4-13(6-7)9-5-8(10)11-14-9/h5,7H,3-4,6H2,1-2H3,(H2,10,11).
What are the key properties of 5-[3-(dimethylamino)pyrrolidin-1-yl]-1,2-thiazol-3-amine?
5-[3-(dimethylamino)pyrrolidin-1-yl]-1,2-thiazol-3-amine has a molecular weight of 212.32 g/mol, XLogP of 0.87, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-(dimethylamino)pyrrolidin-1-yl]-1,2-thiazol-3-amine is sourced from PubChem (CID 103362838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).