N,N-dimethyl-1-(3-methyl-2-methylidene-1,3-thiazolidin-4-yl)methanamine

C8H16N2S — CID 54267395

IUPACN,N-dimethyl-1-(3-methyl-2-methylidene-1,3-thiazolidin-4-yl)methanamine
SMILESC=C1SCC(CN(C)C)N1C
InChIInChI=1S/C8H16N2S/c1-7-10(4)8(6-11-7)5-9(2)3/h8H,1,5-6H2,2-4H3
InChIKeyRHSIXYJZVDPGAA-UHFFFAOYSA-N
MW172.30 g/mol
LogP1.07
Rot. Bonds2

About N,N-dimethyl-1-(3-methyl-2-methylidene-1,3-thiazolidin-4-yl)methanamine

N,N-dimethyl-1-(3-methyl-2-methylidene-1,3-thiazolidin-4-yl)methanamine (PubChem CID 54267395) has the molecular formula C8H16N2S and a molecular weight of 172.30 g/mol. Its IUPAC name is N,N-dimethyl-1-(3-methyl-2-methylidene-1,3-thiazolidin-4-yl)methanamine.

Molecular Properties

Compound NameN,N-dimethyl-1-(3-methyl-2-methylidene-1,3-thiazolidin-4-yl)methanamine
PubChem CID54267395
Molecular FormulaC8H16N2S
Molecular Weight172.30 g/mol
Exact Mass172.10
IUPAC NameN,N-dimethyl-1-(3-methyl-2-methylidene-1,3-thiazolidin-4-yl)methanamine
SMILESC=C1SCC(CN(C)C)N1C
InChIInChI=1S/C8H16N2S/c1-7-10(4)8(6-11-7)5-9(2)3/h8H,1,5-6H2,2-4H3
InChIKeyRHSIXYJZVDPGAA-UHFFFAOYSA-N
XLogP1.07
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.30
LogP ≤ 51.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-(3-methyl-2-methylidene-1,3-thiazolidin-4-yl)methanamine?
The IUPAC name of N,N-dimethyl-1-(3-methyl-2-methylidene-1,3-thiazolidin-4-yl)methanamine (CID 54267395) is N,N-dimethyl-1-(3-methyl-2-methylidene-1,3-thiazolidin-4-yl)methanamine.
What is the SMILES notation for N,N-dimethyl-1-(3-methyl-2-methylidene-1,3-thiazolidin-4-yl)methanamine?
The canonical SMILES for N,N-dimethyl-1-(3-methyl-2-methylidene-1,3-thiazolidin-4-yl)methanamine is C=C1SCC(CN(C)C)N1C.
What is the InChIKey of N,N-dimethyl-1-(3-methyl-2-methylidene-1,3-thiazolidin-4-yl)methanamine?
The InChIKey is RHSIXYJZVDPGAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2S/c1-7-10(4)8(6-11-7)5-9(2)3/h8H,1,5-6H2,2-4H3.
What are the key properties of N,N-dimethyl-1-(3-methyl-2-methylidene-1,3-thiazolidin-4-yl)methanamine?
N,N-dimethyl-1-(3-methyl-2-methylidene-1,3-thiazolidin-4-yl)methanamine has a molecular weight of 172.30 g/mol, XLogP of 1.07, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-(3-methyl-2-methylidene-1,3-thiazolidin-4-yl)methanamine is sourced from PubChem (CID 54267395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).