N-[(2-pyrrolidin-1-yl-1,3-thiazol-5-yl)methyl]pyrazin-2-amine

C12H15N5S — CID 39796621

IUPACN-[(2-pyrrolidin-1-yl-1,3-thiazol-5-yl)methyl]pyrazin-2-amine
SMILESc1cnc(NCc2cnc(N3CCCC3)s2)cn1
InChIInChI=1S/C12H15N5S/c1-2-6-17(5-1)12-16-8-10(18-12)7-15-11-9-13-3-4-14-11/h3-4,8-9H,1-2,5-7H2,(H,14,15)
InChIKeyRHPXOVSJABAHQC-UHFFFAOYSA-N
MW261.35 g/mol
LogP2.15
Rot. Bonds4

About N-[(2-pyrrolidin-1-yl-1,3-thiazol-5-yl)methyl]pyrazin-2-amine

N-[(2-pyrrolidin-1-yl-1,3-thiazol-5-yl)methyl]pyrazin-2-amine (PubChem CID 39796621) has the molecular formula C12H15N5S and a molecular weight of 261.35 g/mol. Its IUPAC name is N-[(2-pyrrolidin-1-yl-1,3-thiazol-5-yl)methyl]pyrazin-2-amine.

Molecular Properties

Compound NameN-[(2-pyrrolidin-1-yl-1,3-thiazol-5-yl)methyl]pyrazin-2-amine
PubChem CID39796621
Molecular FormulaC12H15N5S
Molecular Weight261.35 g/mol
Exact Mass261.10
IUPAC NameN-[(2-pyrrolidin-1-yl-1,3-thiazol-5-yl)methyl]pyrazin-2-amine
SMILESc1cnc(NCc2cnc(N3CCCC3)s2)cn1
InChIInChI=1S/C12H15N5S/c1-2-6-17(5-1)12-16-8-10(18-12)7-15-11-9-13-3-4-14-11/h3-4,8-9H,1-2,5-7H2,(H,14,15)
InChIKeyRHPXOVSJABAHQC-UHFFFAOYSA-N
XLogP2.15
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.35
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[(2-pyrrolidin-1-yl-1,3-thiazol-5-yl)methyl]pyrazin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[(2-pyrrolidin-1-yl-1,3-thiazol-5-yl)methyl]pyrazin-2-amine?
The IUPAC name of N-[(2-pyrrolidin-1-yl-1,3-thiazol-5-yl)methyl]pyrazin-2-amine (CID 39796621) is N-[(2-pyrrolidin-1-yl-1,3-thiazol-5-yl)methyl]pyrazin-2-amine.
What is the SMILES notation for N-[(2-pyrrolidin-1-yl-1,3-thiazol-5-yl)methyl]pyrazin-2-amine?
The canonical SMILES for N-[(2-pyrrolidin-1-yl-1,3-thiazol-5-yl)methyl]pyrazin-2-amine is c1cnc(NCc2cnc(N3CCCC3)s2)cn1.
What is the InChIKey of N-[(2-pyrrolidin-1-yl-1,3-thiazol-5-yl)methyl]pyrazin-2-amine?
The InChIKey is RHPXOVSJABAHQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5S/c1-2-6-17(5-1)12-16-8-10(18-12)7-15-11-9-13-3-4-14-11/h3-4,8-9H,1-2,5-7H2,(H,14,15).
What are the key properties of N-[(2-pyrrolidin-1-yl-1,3-thiazol-5-yl)methyl]pyrazin-2-amine?
N-[(2-pyrrolidin-1-yl-1,3-thiazol-5-yl)methyl]pyrazin-2-amine has a molecular weight of 261.35 g/mol, XLogP of 2.15, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-pyrrolidin-1-yl-1,3-thiazol-5-yl)methyl]pyrazin-2-amine is sourced from PubChem (CID 39796621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).