5-methyl-N-(2-pyrrolidin-1-ylethyl)-1,3-thiazol-2-amine

C10H17N3S — CID 90335005

IUPAC5-methyl-N-(2-pyrrolidin-1-ylethyl)-1,3-thiazol-2-amine
SMILESCc1cnc(NCCN2CCCC2)s1
InChIInChI=1S/C10H17N3S/c1-9-8-12-10(14-9)11-4-7-13-5-2-3-6-13/h8H,2-7H2,1H3,(H,11,12)
InChIKeyPFEQKZJVPJHHKL-UHFFFAOYSA-N
MW211.33 g/mol
LogP1.96
Rot. Bonds4

About 5-methyl-N-(2-pyrrolidin-1-ylethyl)-1,3-thiazol-2-amine

5-methyl-N-(2-pyrrolidin-1-ylethyl)-1,3-thiazol-2-amine (PubChem CID 90335005) has the molecular formula C10H17N3S and a molecular weight of 211.33 g/mol. Its IUPAC name is 5-methyl-N-(2-pyrrolidin-1-ylethyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-methyl-N-(2-pyrrolidin-1-ylethyl)-1,3-thiazol-2-amine
PubChem CID90335005
Molecular FormulaC10H17N3S
Molecular Weight211.33 g/mol
Exact Mass211.11
IUPAC Name5-methyl-N-(2-pyrrolidin-1-ylethyl)-1,3-thiazol-2-amine
SMILESCc1cnc(NCCN2CCCC2)s1
InChIInChI=1S/C10H17N3S/c1-9-8-12-10(14-9)11-4-7-13-5-2-3-6-13/h8H,2-7H2,1H3,(H,11,12)
InChIKeyPFEQKZJVPJHHKL-UHFFFAOYSA-N
XLogP1.96
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(2-pyrrolidin-1-ylethyl)-1,3-thiazol-2-amine?
The IUPAC name of 5-methyl-N-(2-pyrrolidin-1-ylethyl)-1,3-thiazol-2-amine (CID 90335005) is 5-methyl-N-(2-pyrrolidin-1-ylethyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 5-methyl-N-(2-pyrrolidin-1-ylethyl)-1,3-thiazol-2-amine?
The canonical SMILES for 5-methyl-N-(2-pyrrolidin-1-ylethyl)-1,3-thiazol-2-amine is Cc1cnc(NCCN2CCCC2)s1.
What is the InChIKey of 5-methyl-N-(2-pyrrolidin-1-ylethyl)-1,3-thiazol-2-amine?
The InChIKey is PFEQKZJVPJHHKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3S/c1-9-8-12-10(14-9)11-4-7-13-5-2-3-6-13/h8H,2-7H2,1H3,(H,11,12).
What are the key properties of 5-methyl-N-(2-pyrrolidin-1-ylethyl)-1,3-thiazol-2-amine?
5-methyl-N-(2-pyrrolidin-1-ylethyl)-1,3-thiazol-2-amine has a molecular weight of 211.33 g/mol, XLogP of 1.96, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(2-pyrrolidin-1-ylethyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 90335005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).