N-methyl-2-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]pyridin-4-amine

C14H24N4 — CID 79313187

IUPACN-methyl-2-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]pyridin-4-amine
SMILESCNc1ccnc(CN(C)CC2CCCN2C)c1
InChIInChI=1S/C14H24N4/c1-15-12-6-7-16-13(9-12)10-17(2)11-14-5-4-8-18(14)3/h6-7,9,14H,4-5,8,10-11H2,1-3H3,(H,15,16)
InChIKeyQSFKCXRXTOGZPG-UHFFFAOYSA-N
MW248.37 g/mol
LogP1.65
Rot. Bonds5

About N-methyl-2-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]pyridin-4-amine

N-methyl-2-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]pyridin-4-amine (PubChem CID 79313187) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is N-methyl-2-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]pyridin-4-amine.

Molecular Properties

Compound NameN-methyl-2-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]pyridin-4-amine
PubChem CID79313187
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC NameN-methyl-2-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]pyridin-4-amine
SMILESCNc1ccnc(CN(C)CC2CCCN2C)c1
InChIInChI=1S/C14H24N4/c1-15-12-6-7-16-13(9-12)10-17(2)11-14-5-4-8-18(14)3/h6-7,9,14H,4-5,8,10-11H2,1-3H3,(H,15,16)
InChIKeyQSFKCXRXTOGZPG-UHFFFAOYSA-N
XLogP1.65
TPSA31.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]pyridin-4-amine?
The IUPAC name of N-methyl-2-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]pyridin-4-amine (CID 79313187) is N-methyl-2-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]pyridin-4-amine.
What is the SMILES notation for N-methyl-2-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]pyridin-4-amine?
The canonical SMILES for N-methyl-2-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]pyridin-4-amine is CNc1ccnc(CN(C)CC2CCCN2C)c1.
What is the InChIKey of N-methyl-2-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]pyridin-4-amine?
The InChIKey is QSFKCXRXTOGZPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4/c1-15-12-6-7-16-13(9-12)10-17(2)11-14-5-4-8-18(14)3/h6-7,9,14H,4-5,8,10-11H2,1-3H3,(H,15,16).
What are the key properties of N-methyl-2-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]pyridin-4-amine?
N-methyl-2-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]pyridin-4-amine has a molecular weight of 248.37 g/mol, XLogP of 1.65, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]pyridin-4-amine is sourced from PubChem (CID 79313187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).