1-[(1,4-dimethylpiperazin-2-yl)methyl]piperidin-4-amine

C12H26N4 — CID 63896354

IUPAC1-[(1,4-dimethylpiperazin-2-yl)methyl]piperidin-4-amine
SMILESCN1CCN(C)C(CN2CCC(N)CC2)C1
InChIInChI=1S/C12H26N4/c1-14-7-8-15(2)12(9-14)10-16-5-3-11(13)4-6-16/h11-12H,3-10,13H2,1-2H3
InChIKeyKCZKLJJUYUUBGJ-UHFFFAOYSA-N
MW226.37 g/mol
LogP-0.34
Rot. Bonds2

About 1-[(1,4-dimethylpiperazin-2-yl)methyl]piperidin-4-amine

1-[(1,4-dimethylpiperazin-2-yl)methyl]piperidin-4-amine (PubChem CID 63896354) has the molecular formula C12H26N4 and a molecular weight of 226.37 g/mol. Its IUPAC name is 1-[(1,4-dimethylpiperazin-2-yl)methyl]piperidin-4-amine.

Molecular Properties

Compound Name1-[(1,4-dimethylpiperazin-2-yl)methyl]piperidin-4-amine
PubChem CID63896354
Molecular FormulaC12H26N4
Molecular Weight226.37 g/mol
Exact Mass226.22
IUPAC Name1-[(1,4-dimethylpiperazin-2-yl)methyl]piperidin-4-amine
SMILESCN1CCN(C)C(CN2CCC(N)CC2)C1
InChIInChI=1S/C12H26N4/c1-14-7-8-15(2)12(9-14)10-16-5-3-11(13)4-6-16/h11-12H,3-10,13H2,1-2H3
InChIKeyKCZKLJJUYUUBGJ-UHFFFAOYSA-N
XLogP-0.34
TPSA35.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.37
LogP ≤ 5-0.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(1,4-dimethylpiperazin-2-yl)methyl]piperidin-4-one
CID 63898397
N-[[1-[(1,4-dimethylpiperazin-2-yl)methyl]pyrrolidin-3-yl]methyl]ethanamine
CID 63897637
1-[(1-methylpyrrolidin-2-yl)methyl]piperidin-3-amine
CID 106021248
1-(1,4-dimethylpiperazin-2-yl)propan-2-amine
CID 115415048
1-[(1,4-dimethylpiperazin-2-yl)methyl]-3,3-diethylpiperazine
CID 64952021
N-[(1,4-dimethylpiperazin-2-yl)methyl]-1-ethylpiperidin-4-amine
CID 63896493
1-(1,4-dimethylpiperazin-2-yl)-N-methylmethanamine
CID 45099459
2-(2-chloroethyl)-1,4-dimethylpiperazine
CID 178030673
1-[(1,4-dimethylpiperazin-2-yl)methyl]-3-propyl-1,4-diazepane
CID 64951002
1,4-bis[(1-methylazetidin-3-yl)methyl]piperazine
CID 169319674
1-cyclopentyl-2-(1,4-dimethylpiperazin-2-yl)ethanamine
CID 115415158
1-(1,4-dimethylpiperazin-2-yl)-4-ethylhexan-2-amine
CID 82923377

Frequently Asked Questions

What is the IUPAC name of 1-[(1,4-dimethylpiperazin-2-yl)methyl]piperidin-4-amine?
The IUPAC name of 1-[(1,4-dimethylpiperazin-2-yl)methyl]piperidin-4-amine (CID 63896354) is 1-[(1,4-dimethylpiperazin-2-yl)methyl]piperidin-4-amine.
What is the SMILES notation for 1-[(1,4-dimethylpiperazin-2-yl)methyl]piperidin-4-amine?
The canonical SMILES for 1-[(1,4-dimethylpiperazin-2-yl)methyl]piperidin-4-amine is CN1CCN(C)C(CN2CCC(N)CC2)C1.
What is the InChIKey of 1-[(1,4-dimethylpiperazin-2-yl)methyl]piperidin-4-amine?
The InChIKey is KCZKLJJUYUUBGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N4/c1-14-7-8-15(2)12(9-14)10-16-5-3-11(13)4-6-16/h11-12H,3-10,13H2,1-2H3.
What are the key properties of 1-[(1,4-dimethylpiperazin-2-yl)methyl]piperidin-4-amine?
1-[(1,4-dimethylpiperazin-2-yl)methyl]piperidin-4-amine has a molecular weight of 226.37 g/mol, XLogP of -0.34, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1,4-dimethylpiperazin-2-yl)methyl]piperidin-4-amine is sourced from PubChem (CID 63896354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).