N,N-dimethyl-3-(methylaminomethyl)thiolan-3-amine;ethane

C10H24N2S — CID 145087557

IUPACN,N-dimethyl-3-(methylaminomethyl)thiolan-3-amine;ethane
SMILESCC.CNCC1(N(C)C)CCSC1
InChIInChI=1S/C8H18N2S.C2H6/c1-9-6-8(10(2)3)4-5-11-7-8;1-2/h9H,4-7H2,1-3H3;1-2H3
InChIKeyXBOJNWBTCHOGDM-UHFFFAOYSA-N
MW204.38 g/mol
LogP1.67
Rot. Bonds3

About N,N-dimethyl-3-(methylaminomethyl)thiolan-3-amine;ethane

N,N-dimethyl-3-(methylaminomethyl)thiolan-3-amine;ethane (PubChem CID 145087557) has the molecular formula C10H24N2S and a molecular weight of 204.38 g/mol. Its IUPAC name is N,N-dimethyl-3-(methylaminomethyl)thiolan-3-amine;ethane.

Molecular Properties

Compound NameN,N-dimethyl-3-(methylaminomethyl)thiolan-3-amine;ethane
PubChem CID145087557
Molecular FormulaC10H24N2S
Molecular Weight204.38 g/mol
Exact Mass204.17
IUPAC NameN,N-dimethyl-3-(methylaminomethyl)thiolan-3-amine;ethane
SMILESCC.CNCC1(N(C)C)CCSC1
InChIInChI=1S/C8H18N2S.C2H6/c1-9-6-8(10(2)3)4-5-11-7-8;1-2/h9H,4-7H2,1-3H3;1-2H3
InChIKeyXBOJNWBTCHOGDM-UHFFFAOYSA-N
XLogP1.67
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.38
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(aminomethyl)-N-methyl-N-(2,2,2-trifluoroethyl)thiolan-3-amine
CID 114995668
3-(aminomethyl)-N-ethyl-N-(2,2,2-trifluoroethyl)thiolan-3-amine
CID 114996951
3-(aminomethyl)-N,N-dimethylthiolan-3-amine
CID 2779827
4-(ethylsulfanylmethyl)-N,N-dimethylpyrrolidin-3-amine
CID 53776738
4-(aminomethyl)-N,N-dimethylthian-4-amine
CID 61563056
3-(Aminomethyl)-3-(N,N-dimethylamino)tetramethylene Sulfoxide
CID 67060899
Trimethyl-[2-[3-methyl-3-(methylamino)butyl]sulfanylethyl]azanium
CID 90979090
Trimethyl-[3-[3-methyl-3-(methylamino)butyl]sulfanylpropyl]azanium
CID 91466944
N,N-dimethyl-3-[(propan-2-ylamino)methyl]thiolan-3-amine
CID 115906079
N,N-dimethyl-3-(methylaminomethyl)thiolan-3-amine
CID 130440236
(3R,4S)-3-N,3,4-trimethylthiolane-3,4-diamine
CID 135208170
[(3R)-3-(azaniumylmethyl)thiolan-3-yl]-dimethylazanium
CID 6932626

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-3-(methylaminomethyl)thiolan-3-amine;ethane?
The IUPAC name of N,N-dimethyl-3-(methylaminomethyl)thiolan-3-amine;ethane (CID 145087557) is N,N-dimethyl-3-(methylaminomethyl)thiolan-3-amine;ethane.
What is the SMILES notation for N,N-dimethyl-3-(methylaminomethyl)thiolan-3-amine;ethane?
The canonical SMILES for N,N-dimethyl-3-(methylaminomethyl)thiolan-3-amine;ethane is CC.CNCC1(N(C)C)CCSC1.
What is the InChIKey of N,N-dimethyl-3-(methylaminomethyl)thiolan-3-amine;ethane?
The InChIKey is XBOJNWBTCHOGDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2S.C2H6/c1-9-6-8(10(2)3)4-5-11-7-8;1-2/h9H,4-7H2,1-3H3;1-2H3.
What are the key properties of N,N-dimethyl-3-(methylaminomethyl)thiolan-3-amine;ethane?
N,N-dimethyl-3-(methylaminomethyl)thiolan-3-amine;ethane has a molecular weight of 204.38 g/mol, XLogP of 1.67, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-(methylaminomethyl)thiolan-3-amine;ethane is sourced from PubChem (CID 145087557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).