N-ethyl-N-propan-2-yl-1,3-thiazol-2-amine;N-methyl-N-propan-2-yl-1,3-thiazol-2-amine

C15H26N4S2 — CID 157389393

IUPACN-ethyl-N-propan-2-yl-1,3-thiazol-2-amine;N-methyl-N-propan-2-yl-1,3-thiazol-2-amine
SMILESCC(C)N(C)c1nccs1.CCN(c1nccs1)C(C)C
InChIInChI=1S/C8H14N2S.C7H12N2S/c1-4-10(7(2)3)8-9-5-6-11-8;1-6(2)9(3)7-8-4-5-10-7/h5-7H,4H2,1-3H3;4-6H,1-3H3
InChIKeyBLUYXCNZPUIQKY-UHFFFAOYSA-N
MW326.54 g/mol
LogP4.37
Rot. Bonds5

About N-ethyl-N-propan-2-yl-1,3-thiazol-2-amine;N-methyl-N-propan-2-yl-1,3-thiazol-2-amine

N-ethyl-N-propan-2-yl-1,3-thiazol-2-amine;N-methyl-N-propan-2-yl-1,3-thiazol-2-amine (PubChem CID 157389393) has the molecular formula C15H26N4S2 and a molecular weight of 326.54 g/mol. Its IUPAC name is N-ethyl-N-propan-2-yl-1,3-thiazol-2-amine;N-methyl-N-propan-2-yl-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-ethyl-N-propan-2-yl-1,3-thiazol-2-amine;N-methyl-N-propan-2-yl-1,3-thiazol-2-amine
PubChem CID157389393
Molecular FormulaC15H26N4S2
Molecular Weight326.54 g/mol
Exact Mass326.16
IUPAC NameN-ethyl-N-propan-2-yl-1,3-thiazol-2-amine;N-methyl-N-propan-2-yl-1,3-thiazol-2-amine
SMILESCC(C)N(C)c1nccs1.CCN(c1nccs1)C(C)C
InChIInChI=1S/C8H14N2S.C7H12N2S/c1-4-10(7(2)3)8-9-5-6-11-8;1-6(2)9(3)7-8-4-5-10-7/h5-7H,4H2,1-3H3;4-6H,1-3H3
InChIKeyBLUYXCNZPUIQKY-UHFFFAOYSA-N
XLogP4.37
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.54
LogP ≤ 54.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-propan-2-yl-1,3-thiazol-2-amine;N-methyl-N-propan-2-yl-1,3-thiazol-2-amine?
The IUPAC name of N-ethyl-N-propan-2-yl-1,3-thiazol-2-amine;N-methyl-N-propan-2-yl-1,3-thiazol-2-amine (CID 157389393) is N-ethyl-N-propan-2-yl-1,3-thiazol-2-amine;N-methyl-N-propan-2-yl-1,3-thiazol-2-amine.
What is the SMILES notation for N-ethyl-N-propan-2-yl-1,3-thiazol-2-amine;N-methyl-N-propan-2-yl-1,3-thiazol-2-amine?
The canonical SMILES for N-ethyl-N-propan-2-yl-1,3-thiazol-2-amine;N-methyl-N-propan-2-yl-1,3-thiazol-2-amine is CC(C)N(C)c1nccs1.CCN(c1nccs1)C(C)C.
What is the InChIKey of N-ethyl-N-propan-2-yl-1,3-thiazol-2-amine;N-methyl-N-propan-2-yl-1,3-thiazol-2-amine?
The InChIKey is BLUYXCNZPUIQKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2S.C7H12N2S/c1-4-10(7(2)3)8-9-5-6-11-8;1-6(2)9(3)7-8-4-5-10-7/h5-7H,4H2,1-3H3;4-6H,1-3H3.
What are the key properties of N-ethyl-N-propan-2-yl-1,3-thiazol-2-amine;N-methyl-N-propan-2-yl-1,3-thiazol-2-amine?
N-ethyl-N-propan-2-yl-1,3-thiazol-2-amine;N-methyl-N-propan-2-yl-1,3-thiazol-2-amine has a molecular weight of 326.54 g/mol, XLogP of 4.37, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-propan-2-yl-1,3-thiazol-2-amine;N-methyl-N-propan-2-yl-1,3-thiazol-2-amine is sourced from PubChem (CID 157389393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).