N,N-dimethyl-1-(1,3-thiazol-2-yl)pyrrolidin-3-amine

C9H15N3S — CID 130709244

IUPACN,N-dimethyl-1-(1,3-thiazol-2-yl)pyrrolidin-3-amine
SMILESCN(C)C1CCN(c2nccs2)C1
InChIInChI=1S/C9H15N3S/c1-11(2)8-3-5-12(7-8)9-10-4-6-13-9/h4,6,8H,3,5,7H2,1-2H3
InChIKeyAEWXKHDJOXQOBU-UHFFFAOYSA-N
MW197.31 g/mol
LogP1.28
Rot. Bonds2

About N,N-dimethyl-1-(1,3-thiazol-2-yl)pyrrolidin-3-amine

N,N-dimethyl-1-(1,3-thiazol-2-yl)pyrrolidin-3-amine (PubChem CID 130709244) has the molecular formula C9H15N3S and a molecular weight of 197.31 g/mol. Its IUPAC name is N,N-dimethyl-1-(1,3-thiazol-2-yl)pyrrolidin-3-amine.

Molecular Properties

Compound NameN,N-dimethyl-1-(1,3-thiazol-2-yl)pyrrolidin-3-amine
PubChem CID130709244
Molecular FormulaC9H15N3S
Molecular Weight197.31 g/mol
Exact Mass197.10
IUPAC NameN,N-dimethyl-1-(1,3-thiazol-2-yl)pyrrolidin-3-amine
SMILESCN(C)C1CCN(c2nccs2)C1
InChIInChI=1S/C9H15N3S/c1-11(2)8-3-5-12(7-8)9-10-4-6-13-9/h4,6,8H,3,5,7H2,1-2H3
InChIKeyAEWXKHDJOXQOBU-UHFFFAOYSA-N
XLogP1.28
TPSA19.37 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.31
LogP ≤ 51.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-(1-chloroethyl)piperidin-1-yl]-1,3-thiazole
CID 106838472
2-(4-methylsulfonylpiperidin-1-yl)-1,3-thiazole
CID 167862176
ethane;2-pyrrolidin-1-yl-1,3-thiazole
CID 176952882
3-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-8-oxo-5-(1,3-thiazol-2-yl)pyrido[2,3-b]pyrazine-7-carboxylic acid
CID 52919866
7-[3-(dimethylamino)pyrrolidin-1-yl]-N,N-dimethyl-4-oxo-1-(1,3-thiazol-2-yl)-1,8-naphthyridine-3-sulfonamide
CID 67196806
1-(4-chloro-1,3-thiazol-2-yl)-N,N-dimethylpiperidin-3-amine
CID 83157211
(3R)-1-(1,3-thiazol-2-yl)piperidine-3-carboxylic acid
CID 30072707
2-methyl-4-(1,3-thiazol-2-yl)-1,4-oxazepane
CID 131132191
2-(4-piperidin-1-ylpiperidin-1-yl)-1,3-thiazole
CID 172900709
N,N-dimethyl-1-(1,3-thiazol-2-ylmethyl)piperidin-4-amine
CID 141061386
1-(1,3-thiazol-2-yl)azetidin-3-amine;dihydrochloride
CID 91623902
2-[3-(4-bromopyrazol-1-yl)pyrrolidin-1-yl]-1,3-thiazole
CID 126946853

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-(1,3-thiazol-2-yl)pyrrolidin-3-amine?
The IUPAC name of N,N-dimethyl-1-(1,3-thiazol-2-yl)pyrrolidin-3-amine (CID 130709244) is N,N-dimethyl-1-(1,3-thiazol-2-yl)pyrrolidin-3-amine.
What is the SMILES notation for N,N-dimethyl-1-(1,3-thiazol-2-yl)pyrrolidin-3-amine?
The canonical SMILES for N,N-dimethyl-1-(1,3-thiazol-2-yl)pyrrolidin-3-amine is CN(C)C1CCN(c2nccs2)C1.
What is the InChIKey of N,N-dimethyl-1-(1,3-thiazol-2-yl)pyrrolidin-3-amine?
The InChIKey is AEWXKHDJOXQOBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3S/c1-11(2)8-3-5-12(7-8)9-10-4-6-13-9/h4,6,8H,3,5,7H2,1-2H3.
What are the key properties of N,N-dimethyl-1-(1,3-thiazol-2-yl)pyrrolidin-3-amine?
N,N-dimethyl-1-(1,3-thiazol-2-yl)pyrrolidin-3-amine has a molecular weight of 197.31 g/mol, XLogP of 1.28, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-(1,3-thiazol-2-yl)pyrrolidin-3-amine is sourced from PubChem (CID 130709244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).