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

C10H17N3S — CID 87904324

IUPAC4-methyl-5-(1-pyrrolidin-1-ylethyl)-1,3-thiazol-2-amine
SMILESCc1nc(N)sc1C(C)N1CCCC1
InChIInChI=1S/C10H17N3S/c1-7-9(14-10(11)12-7)8(2)13-5-3-4-6-13/h8H,3-6H2,1-2H3,(H2,11,12)
InChIKeyNUOYBGVDEIHIFE-UHFFFAOYSA-N
MW211.33 g/mol
LogP2.19
Rot. Bonds2

About 4-methyl-5-(1-pyrrolidin-1-ylethyl)-1,3-thiazol-2-amine

4-methyl-5-(1-pyrrolidin-1-ylethyl)-1,3-thiazol-2-amine (PubChem CID 87904324) has the molecular formula C10H17N3S and a molecular weight of 211.33 g/mol. Its IUPAC name is 4-methyl-5-(1-pyrrolidin-1-ylethyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-methyl-5-(1-pyrrolidin-1-ylethyl)-1,3-thiazol-2-amine
PubChem CID87904324
Molecular FormulaC10H17N3S
Molecular Weight211.33 g/mol
Exact Mass211.11
IUPAC Name4-methyl-5-(1-pyrrolidin-1-ylethyl)-1,3-thiazol-2-amine
SMILESCc1nc(N)sc1C(C)N1CCCC1
InChIInChI=1S/C10H17N3S/c1-7-9(14-10(11)12-7)8(2)13-5-3-4-6-13/h8H,3-6H2,1-2H3,(H2,11,12)
InChIKeyNUOYBGVDEIHIFE-UHFFFAOYSA-N
XLogP2.19
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-5-(1-pyrrolidin-1-ylethyl)-1,3-thiazol-2-amine?
The IUPAC name of 4-methyl-5-(1-pyrrolidin-1-ylethyl)-1,3-thiazol-2-amine (CID 87904324) is 4-methyl-5-(1-pyrrolidin-1-ylethyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-methyl-5-(1-pyrrolidin-1-ylethyl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-methyl-5-(1-pyrrolidin-1-ylethyl)-1,3-thiazol-2-amine is Cc1nc(N)sc1C(C)N1CCCC1.
What is the InChIKey of 4-methyl-5-(1-pyrrolidin-1-ylethyl)-1,3-thiazol-2-amine?
The InChIKey is NUOYBGVDEIHIFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3S/c1-7-9(14-10(11)12-7)8(2)13-5-3-4-6-13/h8H,3-6H2,1-2H3,(H2,11,12).
What are the key properties of 4-methyl-5-(1-pyrrolidin-1-ylethyl)-1,3-thiazol-2-amine?
4-methyl-5-(1-pyrrolidin-1-ylethyl)-1,3-thiazol-2-amine has a molecular weight of 211.33 g/mol, XLogP of 2.19, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5-(1-pyrrolidin-1-ylethyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 87904324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).