N-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]azetidin-3-amine

C11H24N4 — CID 82892705

IUPACN-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]azetidin-3-amine
SMILESCN1CCN(CCN(C)C2CNC2)CC1
InChIInChI=1S/C11H24N4/c1-13-3-6-15(7-4-13)8-5-14(2)11-9-12-10-11/h11-12H,3-10H2,1-2H3
InChIKeyHBDOROPUJAJEPE-UHFFFAOYSA-N
MW212.34 g/mol
LogP-0.86
Rot. Bonds4

About N-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]azetidin-3-amine

N-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]azetidin-3-amine (PubChem CID 82892705) has the molecular formula C11H24N4 and a molecular weight of 212.34 g/mol. Its IUPAC name is N-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]azetidin-3-amine.

Molecular Properties

Compound NameN-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]azetidin-3-amine
PubChem CID82892705
Molecular FormulaC11H24N4
Molecular Weight212.34 g/mol
Exact Mass212.20
IUPAC NameN-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]azetidin-3-amine
SMILESCN1CCN(CCN(C)C2CNC2)CC1
InChIInChI=1S/C11H24N4/c1-13-3-6-15(7-4-13)8-5-14(2)11-9-12-10-11/h11-12H,3-10H2,1-2H3
InChIKeyHBDOROPUJAJEPE-UHFFFAOYSA-N
XLogP-0.86
TPSA21.75 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 5-0.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(azetidin-3-yl)ethyl]-N,1-dimethylpiperidin-4-amine
CID 116679267
N-methyl-N-[(1-methylpiperidin-4-yl)methyl]azetidin-3-amine
CID 63236886
N,N-dimethyl-2-(4-methylpiperazin-1-yl)ethanamine;ethane
CID 143417406
N-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]cycloheptanamine;N-[2-(4-methylpiperazin-1-yl)ethyl]cycloheptanamine
CID 159997450
ethane;N-methyl-N-propylazetidin-3-amine
CID 144899605
N-(3,3-dimethylbutyl)-N-methylazetidin-3-amine
CID 66186139
4-[methyl(2-pyrrolidin-1-ylethyl)amino]pyrrolidin-3-ol
CID 63702905
N,1-dimethyl-N-(2-morpholin-4-ylethyl)pyrrolidin-3-amine
CID 145256619
2-(azetidin-3-yl)-N-methyl-N-(2-pyrrolidin-1-ylethyl)ethanamine
CID 116680014
N-ethyl-N,N'-dimethyl-N'-[2-(4-methylpiperazin-1-yl)ethyl]ethane-1,2-diamine
CID 145302362
ethane;N,N,N'-trimethyl-N'-(1-methylpiperidin-4-yl)ethane-1,2-diamine
CID 144721860
N-cyclopropyl-N-[2-(4-methylpiperazin-1-yl)ethyl]acetamide
CID 163456508

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]azetidin-3-amine?
The IUPAC name of N-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]azetidin-3-amine (CID 82892705) is N-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]azetidin-3-amine.
What is the SMILES notation for N-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]azetidin-3-amine?
The canonical SMILES for N-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]azetidin-3-amine is CN1CCN(CCN(C)C2CNC2)CC1.
What is the InChIKey of N-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]azetidin-3-amine?
The InChIKey is HBDOROPUJAJEPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N4/c1-13-3-6-15(7-4-13)8-5-14(2)11-9-12-10-11/h11-12H,3-10H2,1-2H3.
What are the key properties of N-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]azetidin-3-amine?
N-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]azetidin-3-amine has a molecular weight of 212.34 g/mol, XLogP of -0.86, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]azetidin-3-amine is sourced from PubChem (CID 82892705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).