N-methyl-1-[5-(3-phenylpyrrolidin-1-yl)pyrazin-2-yl]methanamine

C16H20N4 — CID 107378764

IUPACN-methyl-1-[5-(3-phenylpyrrolidin-1-yl)pyrazin-2-yl]methanamine
SMILESCNCc1cnc(N2CCC(c3ccccc3)C2)cn1
InChIInChI=1S/C16H20N4/c1-17-9-15-10-19-16(11-18-15)20-8-7-14(12-20)13-5-3-2-4-6-13/h2-6,10-11,14,17H,7-9,12H2,1H3
InChIKeyNRXDOAZEXJJFMR-UHFFFAOYSA-N
MW268.36 g/mol
LogP2.19
Rot. Bonds4

About N-methyl-1-[5-(3-phenylpyrrolidin-1-yl)pyrazin-2-yl]methanamine

N-methyl-1-[5-(3-phenylpyrrolidin-1-yl)pyrazin-2-yl]methanamine (PubChem CID 107378764) has the molecular formula C16H20N4 and a molecular weight of 268.36 g/mol. Its IUPAC name is N-methyl-1-[5-(3-phenylpyrrolidin-1-yl)pyrazin-2-yl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[5-(3-phenylpyrrolidin-1-yl)pyrazin-2-yl]methanamine
PubChem CID107378764
Molecular FormulaC16H20N4
Molecular Weight268.36 g/mol
Exact Mass268.17
IUPAC NameN-methyl-1-[5-(3-phenylpyrrolidin-1-yl)pyrazin-2-yl]methanamine
SMILESCNCc1cnc(N2CCC(c3ccccc3)C2)cn1
InChIInChI=1S/C16H20N4/c1-17-9-15-10-19-16(11-18-15)20-8-7-14(12-20)13-5-3-2-4-6-13/h2-6,10-11,14,17H,7-9,12H2,1H3
InChIKeyNRXDOAZEXJJFMR-UHFFFAOYSA-N
XLogP2.19
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-methyl-1-[5-(3-phenylpyrrolidin-1-yl)pyrazin-2-yl]methanamine 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-methyl-1-[5-(3-phenylpyrrolidin-1-yl)pyrazin-2-yl]methanamine?
The IUPAC name of N-methyl-1-[5-(3-phenylpyrrolidin-1-yl)pyrazin-2-yl]methanamine (CID 107378764) is N-methyl-1-[5-(3-phenylpyrrolidin-1-yl)pyrazin-2-yl]methanamine.
What is the SMILES notation for N-methyl-1-[5-(3-phenylpyrrolidin-1-yl)pyrazin-2-yl]methanamine?
The canonical SMILES for N-methyl-1-[5-(3-phenylpyrrolidin-1-yl)pyrazin-2-yl]methanamine is CNCc1cnc(N2CCC(c3ccccc3)C2)cn1.
What is the InChIKey of N-methyl-1-[5-(3-phenylpyrrolidin-1-yl)pyrazin-2-yl]methanamine?
The InChIKey is NRXDOAZEXJJFMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4/c1-17-9-15-10-19-16(11-18-15)20-8-7-14(12-20)13-5-3-2-4-6-13/h2-6,10-11,14,17H,7-9,12H2,1H3.
What are the key properties of N-methyl-1-[5-(3-phenylpyrrolidin-1-yl)pyrazin-2-yl]methanamine?
N-methyl-1-[5-(3-phenylpyrrolidin-1-yl)pyrazin-2-yl]methanamine has a molecular weight of 268.36 g/mol, XLogP of 2.19, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[5-(3-phenylpyrrolidin-1-yl)pyrazin-2-yl]methanamine is sourced from PubChem (CID 107378764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).