N-(dicyclopropylmethyl)-4,5-dihydro-1,3-thiazol-2-amine

C10H16N2S — CID 54440978

IUPACN-(dicyclopropylmethyl)-4,5-dihydro-1,3-thiazol-2-amine
SMILESC1CSC(NC(C2CC2)C2CC2)=N1
InChIInChI=1S/C10H16N2S/c1-2-7(1)9(8-3-4-8)12-10-11-5-6-13-10/h7-9H,1-6H2,(H,11,12)
InChIKeyWOBIGCARBWNNED-UHFFFAOYSA-N
MW196.32 g/mol
LogP1.87
Rot. Bonds3

About N-(dicyclopropylmethyl)-4,5-dihydro-1,3-thiazol-2-amine

N-(dicyclopropylmethyl)-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 54440978) has the molecular formula C10H16N2S and a molecular weight of 196.32 g/mol. Its IUPAC name is N-(dicyclopropylmethyl)-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(dicyclopropylmethyl)-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID54440978
Molecular FormulaC10H16N2S
Molecular Weight196.32 g/mol
Exact Mass196.10
IUPAC NameN-(dicyclopropylmethyl)-4,5-dihydro-1,3-thiazol-2-amine
SMILESC1CSC(NC(C2CC2)C2CC2)=N1
InChIInChI=1S/C10H16N2S/c1-2-7(1)9(8-3-4-8)12-10-11-5-6-13-10/h7-9H,1-6H2,(H,11,12)
InChIKeyWOBIGCARBWNNED-UHFFFAOYSA-N
XLogP1.87
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.32
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(dicyclopropylmethyl)-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of N-(dicyclopropylmethyl)-4,5-dihydro-1,3-thiazol-2-amine (CID 54440978) is N-(dicyclopropylmethyl)-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for N-(dicyclopropylmethyl)-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for N-(dicyclopropylmethyl)-4,5-dihydro-1,3-thiazol-2-amine is C1CSC(NC(C2CC2)C2CC2)=N1.
What is the InChIKey of N-(dicyclopropylmethyl)-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is WOBIGCARBWNNED-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2S/c1-2-7(1)9(8-3-4-8)12-10-11-5-6-13-10/h7-9H,1-6H2,(H,11,12).
What are the key properties of N-(dicyclopropylmethyl)-4,5-dihydro-1,3-thiazol-2-amine?
N-(dicyclopropylmethyl)-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 196.32 g/mol, XLogP of 1.87, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(dicyclopropylmethyl)-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 54440978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).