2-methyl-N-[(4-methylpiperazin-2-yl)methyl]-2-pyridin-3-ylpropan-1-amine

C15H26N4 — CID 115238821

IUPAC2-methyl-N-[(4-methylpiperazin-2-yl)methyl]-2-pyridin-3-ylpropan-1-amine
SMILESCN1CCNC(CNCC(C)(C)c2cccnc2)C1
InChIInChI=1S/C15H26N4/c1-15(2,13-5-4-6-16-9-13)12-17-10-14-11-19(3)8-7-18-14/h4-6,9,14,17-18H,7-8,10-12H2,1-3H3
InChIKeyBELMYBJEJVMGFG-UHFFFAOYSA-N
MW262.40 g/mol
LogP0.85
Rot. Bonds5

About 2-methyl-N-[(4-methylpiperazin-2-yl)methyl]-2-pyridin-3-ylpropan-1-amine

2-methyl-N-[(4-methylpiperazin-2-yl)methyl]-2-pyridin-3-ylpropan-1-amine (PubChem CID 115238821) has the molecular formula C15H26N4 and a molecular weight of 262.40 g/mol. Its IUPAC name is 2-methyl-N-[(4-methylpiperazin-2-yl)methyl]-2-pyridin-3-ylpropan-1-amine.

Molecular Properties

Compound Name2-methyl-N-[(4-methylpiperazin-2-yl)methyl]-2-pyridin-3-ylpropan-1-amine
PubChem CID115238821
Molecular FormulaC15H26N4
Molecular Weight262.40 g/mol
Exact Mass262.22
IUPAC Name2-methyl-N-[(4-methylpiperazin-2-yl)methyl]-2-pyridin-3-ylpropan-1-amine
SMILESCN1CCNC(CNCC(C)(C)c2cccnc2)C1
InChIInChI=1S/C15H26N4/c1-15(2,13-5-4-6-16-9-13)12-17-10-14-11-19(3)8-7-18-14/h4-6,9,14,17-18H,7-8,10-12H2,1-3H3
InChIKeyBELMYBJEJVMGFG-UHFFFAOYSA-N
XLogP0.85
TPSA40.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-N-(piperidin-4-ylmethyl)-2-pyridin-3-ylpropan-1-amine
CID 115210078
2-methyl-2-pyridin-3-yl-N-(pyrrolidin-3-ylmethyl)propan-1-amine
CID 115209149
2-(4-methylpiperazin-2-yl)-N-(2-pyridin-3-ylethyl)ethanamine
CID 115239483
N-methyl-N-[2-(4-methylpiperazin-2-yl)ethyl]pyridin-3-amine
CID 115239388
2-(4-methylpiperazin-2-yl)-1-pyridin-3-ylethanone
CID 116920038
2,2,3-trimethyl-N-[(4-methylpiperazin-2-yl)methyl]butan-1-amine
CID 115238815
N-methyl-2-(4-methylpiperazin-2-yl)-N-(pyridin-3-ylmethyl)ethanamine
CID 115239455
2-methyl-N-(piperidin-2-ylmethyl)-2-pyridin-4-ylpropan-1-amine
CID 115209463
N-[(2-bromophenyl)methyl]-1-(4-methylpiperazin-2-yl)methanamine
CID 115238694
2-methyl-N-(morpholin-3-ylmethyl)-2-pyridin-4-ylpropan-1-amine
CID 115238222
N-[(4-bromophenyl)methyl]-1-(4-methylpiperazin-2-yl)methanamine
CID 115238651
2-(4-methylphenyl)-N-[(4-methylpiperazin-2-yl)methyl]ethanamine
CID 115238743

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(4-methylpiperazin-2-yl)methyl]-2-pyridin-3-ylpropan-1-amine?
The IUPAC name of 2-methyl-N-[(4-methylpiperazin-2-yl)methyl]-2-pyridin-3-ylpropan-1-amine (CID 115238821) is 2-methyl-N-[(4-methylpiperazin-2-yl)methyl]-2-pyridin-3-ylpropan-1-amine.
What is the SMILES notation for 2-methyl-N-[(4-methylpiperazin-2-yl)methyl]-2-pyridin-3-ylpropan-1-amine?
The canonical SMILES for 2-methyl-N-[(4-methylpiperazin-2-yl)methyl]-2-pyridin-3-ylpropan-1-amine is CN1CCNC(CNCC(C)(C)c2cccnc2)C1.
What is the InChIKey of 2-methyl-N-[(4-methylpiperazin-2-yl)methyl]-2-pyridin-3-ylpropan-1-amine?
The InChIKey is BELMYBJEJVMGFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4/c1-15(2,13-5-4-6-16-9-13)12-17-10-14-11-19(3)8-7-18-14/h4-6,9,14,17-18H,7-8,10-12H2,1-3H3.
What are the key properties of 2-methyl-N-[(4-methylpiperazin-2-yl)methyl]-2-pyridin-3-ylpropan-1-amine?
2-methyl-N-[(4-methylpiperazin-2-yl)methyl]-2-pyridin-3-ylpropan-1-amine has a molecular weight of 262.40 g/mol, XLogP of 0.85, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(4-methylpiperazin-2-yl)methyl]-2-pyridin-3-ylpropan-1-amine is sourced from PubChem (CID 115238821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).