[2-[6-(methylamino)pyrazin-2-yl]pyrrolidin-1-yl]-(1-methylpiperidin-4-yl)methanone

C16H25N5O — CID 110271207

IUPAC[2-[6-(methylamino)pyrazin-2-yl]pyrrolidin-1-yl]-(1-methylpiperidin-4-yl)methanone
SMILESCNc1cncc(C2CCCN2C(=O)C2CCN(C)CC2)n1
InChIInChI=1S/C16H25N5O/c1-17-15-11-18-10-13(19-15)14-4-3-7-21(14)16(22)12-5-8-20(2)9-6-12/h10-12,14H,3-9H2,1-2H3,(H,17,19)
InChIKeyRCILBEKYCFPAIC-UHFFFAOYSA-N
MW303.41 g/mol
LogP1.52
Rot. Bonds3

About [2-[6-(methylamino)pyrazin-2-yl]pyrrolidin-1-yl]-(1-methylpiperidin-4-yl)methanone

[2-[6-(methylamino)pyrazin-2-yl]pyrrolidin-1-yl]-(1-methylpiperidin-4-yl)methanone (PubChem CID 110271207) has the molecular formula C16H25N5O and a molecular weight of 303.41 g/mol. Its IUPAC name is [2-[6-(methylamino)pyrazin-2-yl]pyrrolidin-1-yl]-(1-methylpiperidin-4-yl)methanone.

Molecular Properties

Compound Name[2-[6-(methylamino)pyrazin-2-yl]pyrrolidin-1-yl]-(1-methylpiperidin-4-yl)methanone
PubChem CID110271207
Molecular FormulaC16H25N5O
Molecular Weight303.41 g/mol
Exact Mass303.21
IUPAC Name[2-[6-(methylamino)pyrazin-2-yl]pyrrolidin-1-yl]-(1-methylpiperidin-4-yl)methanone
SMILESCNc1cncc(C2CCCN2C(=O)C2CCN(C)CC2)n1
InChIInChI=1S/C16H25N5O/c1-17-15-11-18-10-13(19-15)14-4-3-7-21(14)16(22)12-5-8-20(2)9-6-12/h10-12,14H,3-9H2,1-2H3,(H,17,19)
InChIKeyRCILBEKYCFPAIC-UHFFFAOYSA-N
XLogP1.52
TPSA61.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.41
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [2-[6-(methylamino)pyrazin-2-yl]pyrrolidin-1-yl]-(1-methylpiperidin-4-yl)methanone 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 [2-[6-(methylamino)pyrazin-2-yl]pyrrolidin-1-yl]-(1-methylpiperidin-4-yl)methanone?
The IUPAC name of [2-[6-(methylamino)pyrazin-2-yl]pyrrolidin-1-yl]-(1-methylpiperidin-4-yl)methanone (CID 110271207) is [2-[6-(methylamino)pyrazin-2-yl]pyrrolidin-1-yl]-(1-methylpiperidin-4-yl)methanone.
What is the SMILES notation for [2-[6-(methylamino)pyrazin-2-yl]pyrrolidin-1-yl]-(1-methylpiperidin-4-yl)methanone?
The canonical SMILES for [2-[6-(methylamino)pyrazin-2-yl]pyrrolidin-1-yl]-(1-methylpiperidin-4-yl)methanone is CNc1cncc(C2CCCN2C(=O)C2CCN(C)CC2)n1.
What is the InChIKey of [2-[6-(methylamino)pyrazin-2-yl]pyrrolidin-1-yl]-(1-methylpiperidin-4-yl)methanone?
The InChIKey is RCILBEKYCFPAIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N5O/c1-17-15-11-18-10-13(19-15)14-4-3-7-21(14)16(22)12-5-8-20(2)9-6-12/h10-12,14H,3-9H2,1-2H3,(H,17,19).
What are the key properties of [2-[6-(methylamino)pyrazin-2-yl]pyrrolidin-1-yl]-(1-methylpiperidin-4-yl)methanone?
[2-[6-(methylamino)pyrazin-2-yl]pyrrolidin-1-yl]-(1-methylpiperidin-4-yl)methanone has a molecular weight of 303.41 g/mol, XLogP of 1.52, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[6-(methylamino)pyrazin-2-yl]pyrrolidin-1-yl]-(1-methylpiperidin-4-yl)methanone is sourced from PubChem (CID 110271207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).