1-(1,4-dimethylpiperazin-2-yl)-N-methylmethanamine

C8H19N3 — CID 45099459

IUPAC1-(1,4-dimethylpiperazin-2-yl)-N-methylmethanamine
SMILESCNCC1CN(C)CCN1C
InChIInChI=1S/C8H19N3/c1-9-6-8-7-10(2)4-5-11(8)3/h8-9H,4-7H2,1-3H3
InChIKeyXNUXRINROJGIOE-UHFFFAOYSA-N
MW157.26 g/mol
LogP-0.55
Rot. Bonds2

About 1-(1,4-dimethylpiperazin-2-yl)-N-methylmethanamine

1-(1,4-dimethylpiperazin-2-yl)-N-methylmethanamine (PubChem CID 45099459) has the molecular formula C8H19N3 and a molecular weight of 157.26 g/mol. Its IUPAC name is 1-(1,4-dimethylpiperazin-2-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(1,4-dimethylpiperazin-2-yl)-N-methylmethanamine
PubChem CID45099459
Molecular FormulaC8H19N3
Molecular Weight157.26 g/mol
Exact Mass157.16
IUPAC Name1-(1,4-dimethylpiperazin-2-yl)-N-methylmethanamine
SMILESCNCC1CN(C)CCN1C
InChIInChI=1S/C8H19N3/c1-9-6-8-7-10(2)4-5-11(8)3/h8-9H,4-7H2,1-3H3
InChIKeyXNUXRINROJGIOE-UHFFFAOYSA-N
XLogP-0.55
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 5-0.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-1-(1-methylaziridin-2-yl)methanamine
CID 117010139
N-[(1,4-dimethylpiperazin-2-yl)methyl]-2-(methylamino)acetamide
CID 63898995
N-[(1,4-dimethylpiperazin-2-yl)methyl]-1-(1-methylpiperidin-4-yl)methanamine
CID 63898158
N-methyl-1-(4-methyl-1-pentylpiperazin-2-yl)methanamine
CID 117003742
1-[4-(3-methoxypropyl)-1-methylpiperazin-2-yl]-N-methylmethanamine
CID 117026993
N-[(1,4-dimethylpiperazin-2-yl)methyl]heptan-1-amine
CID 63899137
2-[(1,4-dimethylpiperazin-2-yl)methylamino]-N-(methylcarbamoyl)propanamide
CID 63897620
N-[(4-bromophenyl)methyl]-1-(1,4-dimethylpiperazin-2-yl)methanamine
CID 63897217
N-[(1,4-dimethylpiperazin-2-yl)methyl]-1-ethylpiperidin-4-amine
CID 63896493
N-[(1,4-dimethylpiperazin-2-yl)methyl]-1-(1-methylcyclopropyl)ethanamine
CID 63898738
N-[(1,4-dimethylpiperazin-2-yl)methyl]-5,5-dimethylhexan-2-amine
CID 114279927
3-[(1,4-dimethylpiperazin-2-yl)methylamino]propane-1,2-diol
CID 77011342

Frequently Asked Questions

What is the IUPAC name of 1-(1,4-dimethylpiperazin-2-yl)-N-methylmethanamine?
The IUPAC name of 1-(1,4-dimethylpiperazin-2-yl)-N-methylmethanamine (CID 45099459) is 1-(1,4-dimethylpiperazin-2-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(1,4-dimethylpiperazin-2-yl)-N-methylmethanamine?
The canonical SMILES for 1-(1,4-dimethylpiperazin-2-yl)-N-methylmethanamine is CNCC1CN(C)CCN1C.
What is the InChIKey of 1-(1,4-dimethylpiperazin-2-yl)-N-methylmethanamine?
The InChIKey is XNUXRINROJGIOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19N3/c1-9-6-8-7-10(2)4-5-11(8)3/h8-9H,4-7H2,1-3H3.
What are the key properties of 1-(1,4-dimethylpiperazin-2-yl)-N-methylmethanamine?
1-(1,4-dimethylpiperazin-2-yl)-N-methylmethanamine has a molecular weight of 157.26 g/mol, XLogP of -0.55, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,4-dimethylpiperazin-2-yl)-N-methylmethanamine is sourced from PubChem (CID 45099459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).