N,N-dibutyl-4-tert-butyl-1,3-thiazol-2-amine

C15H28N2S — CID 15277853

IUPACN,N-dibutyl-4-tert-butyl-1,3-thiazol-2-amine
SMILESCCCCN(CCCC)c1nc(C(C)(C)C)cs1
InChIInChI=1S/C15H28N2S/c1-6-8-10-17(11-9-7-2)14-16-13(12-18-14)15(3,4)5/h12H,6-11H2,1-5H3
InChIKeyVVYOMSIENMVPKA-UHFFFAOYSA-N
MW268.47 g/mol
LogP4.85
Rot. Bonds7

About N,N-dibutyl-4-tert-butyl-1,3-thiazol-2-amine

N,N-dibutyl-4-tert-butyl-1,3-thiazol-2-amine (PubChem CID 15277853) has the molecular formula C15H28N2S and a molecular weight of 268.47 g/mol. Its IUPAC name is N,N-dibutyl-4-tert-butyl-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN,N-dibutyl-4-tert-butyl-1,3-thiazol-2-amine
PubChem CID15277853
Molecular FormulaC15H28N2S
Molecular Weight268.47 g/mol
Exact Mass268.20
IUPAC NameN,N-dibutyl-4-tert-butyl-1,3-thiazol-2-amine
SMILESCCCCN(CCCC)c1nc(C(C)(C)C)cs1
InChIInChI=1S/C15H28N2S/c1-6-8-10-17(11-9-7-2)14-16-13(12-18-14)15(3,4)5/h12H,6-11H2,1-5H3
InChIKeyVVYOMSIENMVPKA-UHFFFAOYSA-N
XLogP4.85
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.47
LogP ≤ 54.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dibutyl-4-tert-butyl-1,3-thiazol-2-amine?
The IUPAC name of N,N-dibutyl-4-tert-butyl-1,3-thiazol-2-amine (CID 15277853) is N,N-dibutyl-4-tert-butyl-1,3-thiazol-2-amine.
What is the SMILES notation for N,N-dibutyl-4-tert-butyl-1,3-thiazol-2-amine?
The canonical SMILES for N,N-dibutyl-4-tert-butyl-1,3-thiazol-2-amine is CCCCN(CCCC)c1nc(C(C)(C)C)cs1.
What is the InChIKey of N,N-dibutyl-4-tert-butyl-1,3-thiazol-2-amine?
The InChIKey is VVYOMSIENMVPKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2S/c1-6-8-10-17(11-9-7-2)14-16-13(12-18-14)15(3,4)5/h12H,6-11H2,1-5H3.
What are the key properties of N,N-dibutyl-4-tert-butyl-1,3-thiazol-2-amine?
N,N-dibutyl-4-tert-butyl-1,3-thiazol-2-amine has a molecular weight of 268.47 g/mol, XLogP of 4.85, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibutyl-4-tert-butyl-1,3-thiazol-2-amine is sourced from PubChem (CID 15277853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).