3-N,3-N-dimethyl-2-N-[[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methyl]pyrazine-2,3-diamine

C15H25N5 — CID 122557220

IUPAC3-N,3-N-dimethyl-2-N-[[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methyl]pyrazine-2,3-diamine
SMILESCN(C)c1nccnc1NCC1(CN2CCCC2)CC1
InChIInChI=1S/C15H25N5/c1-19(2)14-13(16-7-8-17-14)18-11-15(5-6-15)12-20-9-3-4-10-20/h7-8H,3-6,9-12H2,1-2H3,(H,16,18)
InChIKeyXTSTUSZPTJFPGU-UHFFFAOYSA-N
MW275.40 g/mol
LogP1.83
Rot. Bonds6

About 3-N,3-N-dimethyl-2-N-[[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methyl]pyrazine-2,3-diamine

3-N,3-N-dimethyl-2-N-[[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methyl]pyrazine-2,3-diamine (PubChem CID 122557220) has the molecular formula C15H25N5 and a molecular weight of 275.40 g/mol. Its IUPAC name is 3-N,3-N-dimethyl-2-N-[[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methyl]pyrazine-2,3-diamine.

Molecular Properties

Compound Name3-N,3-N-dimethyl-2-N-[[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methyl]pyrazine-2,3-diamine
PubChem CID122557220
Molecular FormulaC15H25N5
Molecular Weight275.40 g/mol
Exact Mass275.21
IUPAC Name3-N,3-N-dimethyl-2-N-[[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methyl]pyrazine-2,3-diamine
SMILESCN(C)c1nccnc1NCC1(CN2CCCC2)CC1
InChIInChI=1S/C15H25N5/c1-19(2)14-13(16-7-8-17-14)18-11-15(5-6-15)12-20-9-3-4-10-20/h7-8H,3-6,9-12H2,1-2H3,(H,16,18)
InChIKeyXTSTUSZPTJFPGU-UHFFFAOYSA-N
XLogP1.83
TPSA44.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-N,3-N-dimethyl-2-N-[[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methyl]pyrazine-2,3-diamine 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 3-N,3-N-dimethyl-2-N-[[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methyl]pyrazine-2,3-diamine?
The IUPAC name of 3-N,3-N-dimethyl-2-N-[[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methyl]pyrazine-2,3-diamine (CID 122557220) is 3-N,3-N-dimethyl-2-N-[[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methyl]pyrazine-2,3-diamine.
What is the SMILES notation for 3-N,3-N-dimethyl-2-N-[[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methyl]pyrazine-2,3-diamine?
The canonical SMILES for 3-N,3-N-dimethyl-2-N-[[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methyl]pyrazine-2,3-diamine is CN(C)c1nccnc1NCC1(CN2CCCC2)CC1.
What is the InChIKey of 3-N,3-N-dimethyl-2-N-[[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methyl]pyrazine-2,3-diamine?
The InChIKey is XTSTUSZPTJFPGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5/c1-19(2)14-13(16-7-8-17-14)18-11-15(5-6-15)12-20-9-3-4-10-20/h7-8H,3-6,9-12H2,1-2H3,(H,16,18).
What are the key properties of 3-N,3-N-dimethyl-2-N-[[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methyl]pyrazine-2,3-diamine?
3-N,3-N-dimethyl-2-N-[[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methyl]pyrazine-2,3-diamine has a molecular weight of 275.40 g/mol, XLogP of 1.83, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N,3-N-dimethyl-2-N-[[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methyl]pyrazine-2,3-diamine is sourced from PubChem (CID 122557220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).