N-methyl-1-[2-(2-methylpyrrolidin-1-yl)-4-pyridinyl]methanamine

C12H19N3 — CID 62286079

IUPACN-methyl-1-[2-(2-methylpyrrolidin-1-yl)-4-pyridinyl]methanamine
SMILESCNCc1ccnc(N2CCCC2C)c1
InChIInChI=1S/C12H19N3/c1-10-4-3-7-15(10)12-8-11(9-13-2)5-6-14-12/h5-6,8,10,13H,3-4,7,9H2,1-2H3
InChIKeyWCMNJNBLAVUAGV-UHFFFAOYSA-N
MW205.31 g/mol
LogP1.79
Rot. Bonds3

About N-methyl-1-[2-(2-methylpyrrolidin-1-yl)-4-pyridinyl]methanamine

N-methyl-1-[2-(2-methylpyrrolidin-1-yl)-4-pyridinyl]methanamine (PubChem CID 62286079) has the molecular formula C12H19N3 and a molecular weight of 205.31 g/mol. Its IUPAC name is N-methyl-1-[2-(2-methylpyrrolidin-1-yl)-4-pyridinyl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[2-(2-methylpyrrolidin-1-yl)-4-pyridinyl]methanamine
PubChem CID62286079
Molecular FormulaC12H19N3
Molecular Weight205.31 g/mol
Exact Mass205.16
IUPAC NameN-methyl-1-[2-(2-methylpyrrolidin-1-yl)-4-pyridinyl]methanamine
SMILESCNCc1ccnc(N2CCCC2C)c1
InChIInChI=1S/C12H19N3/c1-10-4-3-7-15(10)12-8-11(9-13-2)5-6-14-12/h5-6,8,10,13H,3-4,7,9H2,1-2H3
InChIKeyWCMNJNBLAVUAGV-UHFFFAOYSA-N
XLogP1.79
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.31
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[2-(2-methylpyrrolidin-1-yl)-4-pyridinyl]methanamine?
The IUPAC name of N-methyl-1-[2-(2-methylpyrrolidin-1-yl)-4-pyridinyl]methanamine (CID 62286079) is N-methyl-1-[2-(2-methylpyrrolidin-1-yl)-4-pyridinyl]methanamine.
What is the SMILES notation for N-methyl-1-[2-(2-methylpyrrolidin-1-yl)-4-pyridinyl]methanamine?
The canonical SMILES for N-methyl-1-[2-(2-methylpyrrolidin-1-yl)-4-pyridinyl]methanamine is CNCc1ccnc(N2CCCC2C)c1.
What is the InChIKey of N-methyl-1-[2-(2-methylpyrrolidin-1-yl)-4-pyridinyl]methanamine?
The InChIKey is WCMNJNBLAVUAGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3/c1-10-4-3-7-15(10)12-8-11(9-13-2)5-6-14-12/h5-6,8,10,13H,3-4,7,9H2,1-2H3.
What are the key properties of N-methyl-1-[2-(2-methylpyrrolidin-1-yl)-4-pyridinyl]methanamine?
N-methyl-1-[2-(2-methylpyrrolidin-1-yl)-4-pyridinyl]methanamine has a molecular weight of 205.31 g/mol, XLogP of 1.79, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[2-(2-methylpyrrolidin-1-yl)-4-pyridinyl]methanamine is sourced from PubChem (CID 62286079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).