1-[6-[(2,4-dimethylpiperazin-1-yl)methyl]-2-pyridinyl]-N-methylmethanamine

C14H24N4 — CID 114087777

IUPAC1-[6-[(2,4-dimethylpiperazin-1-yl)methyl]-2-pyridinyl]-N-methylmethanamine
SMILESCNCc1cccc(CN2CCN(C)CC2C)n1
InChIInChI=1S/C14H24N4/c1-12-10-17(3)7-8-18(12)11-14-6-4-5-13(16-14)9-15-2/h4-6,12,15H,7-11H2,1-3H3
InChIKeyKBHAPVICONESFI-UHFFFAOYSA-N
MW248.37 g/mol
LogP0.94
Rot. Bonds4

About 1-[6-[(2,4-dimethylpiperazin-1-yl)methyl]-2-pyridinyl]-N-methylmethanamine

1-[6-[(2,4-dimethylpiperazin-1-yl)methyl]-2-pyridinyl]-N-methylmethanamine (PubChem CID 114087777) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is 1-[6-[(2,4-dimethylpiperazin-1-yl)methyl]-2-pyridinyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[6-[(2,4-dimethylpiperazin-1-yl)methyl]-2-pyridinyl]-N-methylmethanamine
PubChem CID114087777
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC Name1-[6-[(2,4-dimethylpiperazin-1-yl)methyl]-2-pyridinyl]-N-methylmethanamine
SMILESCNCc1cccc(CN2CCN(C)CC2C)n1
InChIInChI=1S/C14H24N4/c1-12-10-17(3)7-8-18(12)11-14-6-4-5-13(16-14)9-15-2/h4-6,12,15H,7-11H2,1-3H3
InChIKeyKBHAPVICONESFI-UHFFFAOYSA-N
XLogP0.94
TPSA31.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-1-[6-[(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)methyl]-2-pyridinyl]methanamine
CID 106906872
N-methyl-1-[6-[(2,3,5-trimethylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine
CID 106907232
1-[6-(azocan-1-ylmethyl)-2-pyridinyl]-N-methylmethanamine
CID 106905663
1-[6-(2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazin-4-ylmethyl)-2-pyridinyl]-N-methylmethanamine
CID 106906421
1-[6-[(3-tert-butylpyrrolidin-1-yl)methyl]-2-pyridinyl]-N-methylmethanamine
CID 106907083
1-benzyl-2,4-dimethylpiperazine;ethane
CID 145145723
N-[[6-[(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methyl]-2-pyridinyl]methyl]ethanamine
CID 106906876
N-[[6-[(2-methylazepan-1-yl)methyl]-2-pyridinyl]methyl]cyclopropanamine
CID 106906708
1-[6-(3,4-dimethylpiperazin-1-yl)-2-pyridinyl]-N-methylmethanamine
CID 63621802
N-[[6-[(3-methylthiomorpholin-4-yl)methyl]-2-pyridinyl]methyl]propan-2-amine
CID 106906683
N-methyl-1-[6-[[4-(trifluoromethyl)piperidin-1-yl]methyl]-2-pyridinyl]methanamine
CID 106906779
3-[(2,4-dimethylpiperazin-1-yl)methyl]benzonitrile
CID 71877621

Frequently Asked Questions

What is the IUPAC name of 1-[6-[(2,4-dimethylpiperazin-1-yl)methyl]-2-pyridinyl]-N-methylmethanamine?
The IUPAC name of 1-[6-[(2,4-dimethylpiperazin-1-yl)methyl]-2-pyridinyl]-N-methylmethanamine (CID 114087777) is 1-[6-[(2,4-dimethylpiperazin-1-yl)methyl]-2-pyridinyl]-N-methylmethanamine.
What is the SMILES notation for 1-[6-[(2,4-dimethylpiperazin-1-yl)methyl]-2-pyridinyl]-N-methylmethanamine?
The canonical SMILES for 1-[6-[(2,4-dimethylpiperazin-1-yl)methyl]-2-pyridinyl]-N-methylmethanamine is CNCc1cccc(CN2CCN(C)CC2C)n1.
What is the InChIKey of 1-[6-[(2,4-dimethylpiperazin-1-yl)methyl]-2-pyridinyl]-N-methylmethanamine?
The InChIKey is KBHAPVICONESFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4/c1-12-10-17(3)7-8-18(12)11-14-6-4-5-13(16-14)9-15-2/h4-6,12,15H,7-11H2,1-3H3.
What are the key properties of 1-[6-[(2,4-dimethylpiperazin-1-yl)methyl]-2-pyridinyl]-N-methylmethanamine?
1-[6-[(2,4-dimethylpiperazin-1-yl)methyl]-2-pyridinyl]-N-methylmethanamine has a molecular weight of 248.37 g/mol, XLogP of 0.94, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-[(2,4-dimethylpiperazin-1-yl)methyl]-2-pyridinyl]-N-methylmethanamine is sourced from PubChem (CID 114087777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).