N,N-diethyl-5-propan-2-yl-1,3-thiazol-2-amine

C10H18N2S — CID 58408238

IUPACN,N-diethyl-5-propan-2-yl-1,3-thiazol-2-amine
SMILESCCN(CC)c1ncc(C(C)C)s1
InChIInChI=1S/C10H18N2S/c1-5-12(6-2)10-11-7-9(13-10)8(3)4/h7-8H,5-6H2,1-4H3
InChIKeyFOHQFDDJLXCKRW-UHFFFAOYSA-N
MW198.33 g/mol
LogP3.11
Rot. Bonds4

About N,N-diethyl-5-propan-2-yl-1,3-thiazol-2-amine

N,N-diethyl-5-propan-2-yl-1,3-thiazol-2-amine (PubChem CID 58408238) has the molecular formula C10H18N2S and a molecular weight of 198.33 g/mol. Its IUPAC name is N,N-diethyl-5-propan-2-yl-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN,N-diethyl-5-propan-2-yl-1,3-thiazol-2-amine
PubChem CID58408238
Molecular FormulaC10H18N2S
Molecular Weight198.33 g/mol
Exact Mass198.12
IUPAC NameN,N-diethyl-5-propan-2-yl-1,3-thiazol-2-amine
SMILESCCN(CC)c1ncc(C(C)C)s1
InChIInChI=1S/C10H18N2S/c1-5-12(6-2)10-11-7-9(13-10)8(3)4/h7-8H,5-6H2,1-4H3
InChIKeyFOHQFDDJLXCKRW-UHFFFAOYSA-N
XLogP3.11
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.33
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-5-propan-2-yl-1,3-thiazol-2-amine?
The IUPAC name of N,N-diethyl-5-propan-2-yl-1,3-thiazol-2-amine (CID 58408238) is N,N-diethyl-5-propan-2-yl-1,3-thiazol-2-amine.
What is the SMILES notation for N,N-diethyl-5-propan-2-yl-1,3-thiazol-2-amine?
The canonical SMILES for N,N-diethyl-5-propan-2-yl-1,3-thiazol-2-amine is CCN(CC)c1ncc(C(C)C)s1.
What is the InChIKey of N,N-diethyl-5-propan-2-yl-1,3-thiazol-2-amine?
The InChIKey is FOHQFDDJLXCKRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2S/c1-5-12(6-2)10-11-7-9(13-10)8(3)4/h7-8H,5-6H2,1-4H3.
What are the key properties of N,N-diethyl-5-propan-2-yl-1,3-thiazol-2-amine?
N,N-diethyl-5-propan-2-yl-1,3-thiazol-2-amine has a molecular weight of 198.33 g/mol, XLogP of 3.11, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-5-propan-2-yl-1,3-thiazol-2-amine is sourced from PubChem (CID 58408238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).