N-methyl-N-[2-(3-methylazetidin-3-yl)ethyl]propan-2-amine;molecular hydrogen

C10H24N2 — CID 176704428

IUPACN-methyl-N-[2-(3-methylazetidin-3-yl)ethyl]propan-2-amine;molecular hydrogen
SMILESCC(C)N(C)CCC1(C)CNC1.[H][H]
InChIInChI=1S/C10H22N2.H2/c1-9(2)12(4)6-5-10(3)7-11-8-10;/h9,11H,5-8H2,1-4H3;1H
InChIKeyLRKDQMDSKDWIEU-UHFFFAOYSA-N
MW172.32 g/mol
LogP1.57
Rot. Bonds4

About N-methyl-N-[2-(3-methylazetidin-3-yl)ethyl]propan-2-amine;molecular hydrogen

N-methyl-N-[2-(3-methylazetidin-3-yl)ethyl]propan-2-amine;molecular hydrogen (PubChem CID 176704428) has the molecular formula C10H24N2 and a molecular weight of 172.32 g/mol. Its IUPAC name is N-methyl-N-[2-(3-methylazetidin-3-yl)ethyl]propan-2-amine;molecular hydrogen.

Molecular Properties

Compound NameN-methyl-N-[2-(3-methylazetidin-3-yl)ethyl]propan-2-amine;molecular hydrogen
PubChem CID176704428
Molecular FormulaC10H24N2
Molecular Weight172.32 g/mol
Exact Mass172.19
IUPAC NameN-methyl-N-[2-(3-methylazetidin-3-yl)ethyl]propan-2-amine;molecular hydrogen
SMILESCC(C)N(C)CCC1(C)CNC1.[H][H]
InChIInChI=1S/C10H22N2.H2/c1-9(2)12(4)6-5-10(3)7-11-8-10;/h9,11H,5-8H2,1-4H3;1H
InChIKeyLRKDQMDSKDWIEU-UHFFFAOYSA-N
XLogP1.57
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.32
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-N-[2-(3-methyloxetan-3-yl)ethyl]propan-2-amine
CID 145201975
ethane;N-methyl-N-[2-(1-methylcyclopentyl)ethyl]propan-2-amine
CID 166552547
N-methyl-N-[2-(1-methyl-3-propan-2-ylcyclobutyl)ethyl]propan-2-amine
CID 170578281
N-methyl-N-[2-(2-methylazetidin-2-yl)ethyl]propan-2-amine
CID 165404573
3-methyl-3-[2-[methyl(propan-2-yl)amino]ethyl]pyrrolidin-1-amine
CID 170055778
1-[2-[methyl(propan-2-yl)amino]ethyl]cyclopropan-1-amine
CID 84763773
3-methyl-3-[2-[methyl(sulfamoyl)amino]propyl]azetidine
CID 163275194
N-[(3-ethylazetidin-3-yl)methyl]-N-methylpropan-2-amine
CID 165404355
N-ethyl-2-(3-methylazetidin-3-yl)ethanamine;molecular hydrogen;propane
CID 166533180
N,N-dimethyl-2-(3-methylpyrrolidin-3-yl)ethanamine;ethane
CID 145166475
N-methyl-N-[2-[1-(trifluoromethyl)cyclopropyl]ethyl]propan-2-amine
CID 178108544
N-(2-methoxyethyl)-N-[2-(3-methylazetidin-3-yl)oxyethyl]propan-2-amine
CID 102657031

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[2-(3-methylazetidin-3-yl)ethyl]propan-2-amine;molecular hydrogen?
The IUPAC name of N-methyl-N-[2-(3-methylazetidin-3-yl)ethyl]propan-2-amine;molecular hydrogen (CID 176704428) is N-methyl-N-[2-(3-methylazetidin-3-yl)ethyl]propan-2-amine;molecular hydrogen.
What is the SMILES notation for N-methyl-N-[2-(3-methylazetidin-3-yl)ethyl]propan-2-amine;molecular hydrogen?
The canonical SMILES for N-methyl-N-[2-(3-methylazetidin-3-yl)ethyl]propan-2-amine;molecular hydrogen is CC(C)N(C)CCC1(C)CNC1.[H][H].
What is the InChIKey of N-methyl-N-[2-(3-methylazetidin-3-yl)ethyl]propan-2-amine;molecular hydrogen?
The InChIKey is LRKDQMDSKDWIEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2.H2/c1-9(2)12(4)6-5-10(3)7-11-8-10;/h9,11H,5-8H2,1-4H3;1H.
What are the key properties of N-methyl-N-[2-(3-methylazetidin-3-yl)ethyl]propan-2-amine;molecular hydrogen?
N-methyl-N-[2-(3-methylazetidin-3-yl)ethyl]propan-2-amine;molecular hydrogen has a molecular weight of 172.32 g/mol, XLogP of 1.57, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[2-(3-methylazetidin-3-yl)ethyl]propan-2-amine;molecular hydrogen is sourced from PubChem (CID 176704428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).