N-(4-ethoxyphenyl)-4,4-diethyl-5H-1,3-thiazol-2-amine

C15H22N2OS — CID 62522939

IUPACN-(4-ethoxyphenyl)-4,4-diethyl-5H-1,3-thiazol-2-amine
SMILESCCOc1ccc(NC2=NC(CC)(CC)CS2)cc1
InChIInChI=1S/C15H22N2OS/c1-4-15(5-2)11-19-14(17-15)16-12-7-9-13(10-8-12)18-6-3/h7-10H,4-6,11H2,1-3H3,(H,16,17)
InChIKeyBKMHJGSZKSIKEQ-UHFFFAOYSA-N
MW278.42 g/mol
LogP4.16
Rot. Bonds5

About N-(4-ethoxyphenyl)-4,4-diethyl-5H-1,3-thiazol-2-amine

N-(4-ethoxyphenyl)-4,4-diethyl-5H-1,3-thiazol-2-amine (PubChem CID 62522939) has the molecular formula C15H22N2OS and a molecular weight of 278.42 g/mol. Its IUPAC name is N-(4-ethoxyphenyl)-4,4-diethyl-5H-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(4-ethoxyphenyl)-4,4-diethyl-5H-1,3-thiazol-2-amine
PubChem CID62522939
Molecular FormulaC15H22N2OS
Molecular Weight278.42 g/mol
Exact Mass278.15
IUPAC NameN-(4-ethoxyphenyl)-4,4-diethyl-5H-1,3-thiazol-2-amine
SMILESCCOc1ccc(NC2=NC(CC)(CC)CS2)cc1
InChIInChI=1S/C15H22N2OS/c1-4-15(5-2)11-19-14(17-15)16-12-7-9-13(10-8-12)18-6-3/h7-10H,4-6,11H2,1-3H3,(H,16,17)
InChIKeyBKMHJGSZKSIKEQ-UHFFFAOYSA-N
XLogP4.16
TPSA33.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.42
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4,4-diethyl-N-[4-(trifluoromethoxy)phenyl]-5H-1,3-thiazol-2-amine
CID 62524656
4,4-diethyl-N-(4-ethylphenyl)-5H-1,3-thiazol-2-amine
CID 55081235
N-(4-chloro-3-fluorophenyl)-4,4-diethyl-5H-1,3-thiazol-2-amine
CID 62517851
N-(3-chloro-4-methoxyphenyl)-4,4-diethyl-5H-1,3-thiazol-2-amine
CID 62523628
4,4-diethyl-N-(3-iodophenyl)-5H-1,3-thiazol-2-amine
CID 62523962
N-(2,2-difluoro-1,3-benzodioxol-5-yl)-4,4-diethyl-5H-1,3-thiazol-2-amine
CID 62524659
4,4-diethyl-N-quinolin-3-yl-5H-1,3-thiazol-2-amine
CID 62781973
1-N,4-N-bis(4-ethoxyphenyl)benzene-1,4-diamine
CID 139791472
N-(4-ethoxyphenyl)-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 2345498
N-(2,5-diethoxyphenyl)-4-ethyl-4-methyl-5H-1,3-thiazol-2-amine
CID 64550265
4,4-diethyl-N-(2-iodophenyl)-5H-1,3-thiazol-2-amine
CID 62524295
(4S)-N-(4-ethoxyphenyl)-4-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine
CID 79247001

Frequently Asked Questions

What is the IUPAC name of N-(4-ethoxyphenyl)-4,4-diethyl-5H-1,3-thiazol-2-amine?
The IUPAC name of N-(4-ethoxyphenyl)-4,4-diethyl-5H-1,3-thiazol-2-amine (CID 62522939) is N-(4-ethoxyphenyl)-4,4-diethyl-5H-1,3-thiazol-2-amine.
What is the SMILES notation for N-(4-ethoxyphenyl)-4,4-diethyl-5H-1,3-thiazol-2-amine?
The canonical SMILES for N-(4-ethoxyphenyl)-4,4-diethyl-5H-1,3-thiazol-2-amine is CCOc1ccc(NC2=NC(CC)(CC)CS2)cc1.
What is the InChIKey of N-(4-ethoxyphenyl)-4,4-diethyl-5H-1,3-thiazol-2-amine?
The InChIKey is BKMHJGSZKSIKEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2OS/c1-4-15(5-2)11-19-14(17-15)16-12-7-9-13(10-8-12)18-6-3/h7-10H,4-6,11H2,1-3H3,(H,16,17).
What are the key properties of N-(4-ethoxyphenyl)-4,4-diethyl-5H-1,3-thiazol-2-amine?
N-(4-ethoxyphenyl)-4,4-diethyl-5H-1,3-thiazol-2-amine has a molecular weight of 278.42 g/mol, XLogP of 4.16, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxyphenyl)-4,4-diethyl-5H-1,3-thiazol-2-amine is sourced from PubChem (CID 62522939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).