N-methyl-N-[(2-methylpyrrolidin-3-yl)methyl]-2-pyridin-2-ylethanamine

C14H23N3 — CID 79385131

IUPACN-methyl-N-[(2-methylpyrrolidin-3-yl)methyl]-2-pyridin-2-ylethanamine
SMILESCC1NCCC1CN(C)CCc1ccccn1
InChIInChI=1S/C14H23N3/c1-12-13(6-9-15-12)11-17(2)10-7-14-5-3-4-8-16-14/h3-5,8,12-13,15H,6-7,9-11H2,1-2H3
InChIKeyWXZCZDUTIJPMBQ-UHFFFAOYSA-N
MW233.36 g/mol
LogP1.55
Rot. Bonds5

About N-methyl-N-[(2-methylpyrrolidin-3-yl)methyl]-2-pyridin-2-ylethanamine

N-methyl-N-[(2-methylpyrrolidin-3-yl)methyl]-2-pyridin-2-ylethanamine (PubChem CID 79385131) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is N-methyl-N-[(2-methylpyrrolidin-3-yl)methyl]-2-pyridin-2-ylethanamine.

Molecular Properties

Compound NameN-methyl-N-[(2-methylpyrrolidin-3-yl)methyl]-2-pyridin-2-ylethanamine
PubChem CID79385131
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC NameN-methyl-N-[(2-methylpyrrolidin-3-yl)methyl]-2-pyridin-2-ylethanamine
SMILESCC1NCCC1CN(C)CCc1ccccn1
InChIInChI=1S/C14H23N3/c1-12-13(6-9-15-12)11-17(2)10-7-14-5-3-4-8-16-14/h3-5,8,12-13,15H,6-7,9-11H2,1-2H3
InChIKeyWXZCZDUTIJPMBQ-UHFFFAOYSA-N
XLogP1.55
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(2-methylpyrrolidin-3-yl)methyl]-2-pyridin-2-ylethanamine?
The IUPAC name of N-methyl-N-[(2-methylpyrrolidin-3-yl)methyl]-2-pyridin-2-ylethanamine (CID 79385131) is N-methyl-N-[(2-methylpyrrolidin-3-yl)methyl]-2-pyridin-2-ylethanamine.
What is the SMILES notation for N-methyl-N-[(2-methylpyrrolidin-3-yl)methyl]-2-pyridin-2-ylethanamine?
The canonical SMILES for N-methyl-N-[(2-methylpyrrolidin-3-yl)methyl]-2-pyridin-2-ylethanamine is CC1NCCC1CN(C)CCc1ccccn1.
What is the InChIKey of N-methyl-N-[(2-methylpyrrolidin-3-yl)methyl]-2-pyridin-2-ylethanamine?
The InChIKey is WXZCZDUTIJPMBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-12-13(6-9-15-12)11-17(2)10-7-14-5-3-4-8-16-14/h3-5,8,12-13,15H,6-7,9-11H2,1-2H3.
What are the key properties of N-methyl-N-[(2-methylpyrrolidin-3-yl)methyl]-2-pyridin-2-ylethanamine?
N-methyl-N-[(2-methylpyrrolidin-3-yl)methyl]-2-pyridin-2-ylethanamine has a molecular weight of 233.36 g/mol, XLogP of 1.55, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(2-methylpyrrolidin-3-yl)methyl]-2-pyridin-2-ylethanamine is sourced from PubChem (CID 79385131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).