1-[(2S)-azetidin-2-yl]-N,N-dimethylmethanamine;ethane

C8H20N2 — CID 156727541

IUPAC1-[(2S)-azetidin-2-yl]-N,N-dimethylmethanamine;ethane
SMILESCC.CN(C)C[C@@H]1CCN1
InChIInChI=1S/C6H14N2.C2H6/c1-8(2)5-6-3-4-7-6;1-2/h6-7H,3-5H2,1-2H3;1-2H3/t6-;/m0./s1
InChIKeyIZDDQUSUFDKSHT-RGMNGODLSA-N
MW144.26 g/mol
LogP0.94
Rot. Bonds2

About 1-[(2S)-azetidin-2-yl]-N,N-dimethylmethanamine;ethane

1-[(2S)-azetidin-2-yl]-N,N-dimethylmethanamine;ethane (PubChem CID 156727541) has the molecular formula C8H20N2 and a molecular weight of 144.26 g/mol. Its IUPAC name is 1-[(2S)-azetidin-2-yl]-N,N-dimethylmethanamine;ethane.

Molecular Properties

Compound Name1-[(2S)-azetidin-2-yl]-N,N-dimethylmethanamine;ethane
PubChem CID156727541
Molecular FormulaC8H20N2
Molecular Weight144.26 g/mol
Exact Mass144.16
IUPAC Name1-[(2S)-azetidin-2-yl]-N,N-dimethylmethanamine;ethane
SMILESCC.CN(C)C[C@@H]1CCN1
InChIInChI=1S/C6H14N2.C2H6/c1-8(2)5-6-3-4-7-6;1-2/h6-7H,3-5H2,1-2H3;1-2H3/t6-;/m0./s1
InChIKeyIZDDQUSUFDKSHT-RGMNGODLSA-N
XLogP0.94
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.26
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(2S)-azetidin-2-yl]-N,N-dimethylmethanamine;2,2,2-trifluoroacetic acid
CID 170906116
N,N-dimethyl-1-piperidin-2-ylmethanamine;dihydrochloride
CID 45075192
1-(aziridin-2-yl)-N,N-dimethylmethanamine
CID 54502555
acetylene;N,N-dimethyl-1-[(2R)-pyrrolidin-2-yl]methanamine;molecular hydrogen
CID 171531463
N-(azetidin-2-ylmethyl)-N,2-dimethylpropan-2-amine
CID 130948944
ethane;2-ethylazetidine
CID 90717086
N,N-dimethyl-1-(3-methylpyrrolidin-2-yl)methanamine
CID 103846085
N,N-dimethyl-1-(4-methylpyrrolidin-2-yl)methanamine;ethane
CID 168883366
N,N-dimethyl-N'-propyl-N'-[[(2S)-pyrrolidin-2-yl]methyl]ethane-1,2-diamine
CID 104870166
N-ethyl-N-(pyrrolidin-2-ylmethyl)ethanamine
CID 4715267
5-[(dimethylamino)methyl]pyrrolidin-3-ol
CID 66055756
1-[(2R,6R)-5,5-difluoro-6-methylpiperidin-2-yl]-N,N-dimethylmethanamine
CID 176992598

Frequently Asked Questions

What is the IUPAC name of 1-[(2S)-azetidin-2-yl]-N,N-dimethylmethanamine;ethane?
The IUPAC name of 1-[(2S)-azetidin-2-yl]-N,N-dimethylmethanamine;ethane (CID 156727541) is 1-[(2S)-azetidin-2-yl]-N,N-dimethylmethanamine;ethane.
What is the SMILES notation for 1-[(2S)-azetidin-2-yl]-N,N-dimethylmethanamine;ethane?
The canonical SMILES for 1-[(2S)-azetidin-2-yl]-N,N-dimethylmethanamine;ethane is CC.CN(C)C[C@@H]1CCN1.
What is the InChIKey of 1-[(2S)-azetidin-2-yl]-N,N-dimethylmethanamine;ethane?
The InChIKey is IZDDQUSUFDKSHT-RGMNGODLSA-N. The full InChI is InChI=1S/C6H14N2.C2H6/c1-8(2)5-6-3-4-7-6;1-2/h6-7H,3-5H2,1-2H3;1-2H3/t6-;/m0./s1.
What are the key properties of 1-[(2S)-azetidin-2-yl]-N,N-dimethylmethanamine;ethane?
1-[(2S)-azetidin-2-yl]-N,N-dimethylmethanamine;ethane has a molecular weight of 144.26 g/mol, XLogP of 0.94, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2S)-azetidin-2-yl]-N,N-dimethylmethanamine;ethane is sourced from PubChem (CID 156727541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).