2-ethyl-N-propan-2-yl-1-(4-propan-2-yl-1,3-thiazol-2-yl)butan-1-amine

C15H28N2S — CID 61334636

IUPAC2-ethyl-N-propan-2-yl-1-(4-propan-2-yl-1,3-thiazol-2-yl)butan-1-amine
SMILESCCC(CC)C(NC(C)C)c1nc(C(C)C)cs1
InChIInChI=1S/C15H28N2S/c1-7-12(8-2)14(16-11(5)6)15-17-13(9-18-15)10(3)4/h9-12,14,16H,7-8H2,1-6H3
InChIKeyFCXFXNHAMQCWRX-UHFFFAOYSA-N
MW268.47 g/mol
LogP4.74
Rot. Bonds7

About 2-ethyl-N-propan-2-yl-1-(4-propan-2-yl-1,3-thiazol-2-yl)butan-1-amine

2-ethyl-N-propan-2-yl-1-(4-propan-2-yl-1,3-thiazol-2-yl)butan-1-amine (PubChem CID 61334636) has the molecular formula C15H28N2S and a molecular weight of 268.47 g/mol. Its IUPAC name is 2-ethyl-N-propan-2-yl-1-(4-propan-2-yl-1,3-thiazol-2-yl)butan-1-amine.

Molecular Properties

Compound Name2-ethyl-N-propan-2-yl-1-(4-propan-2-yl-1,3-thiazol-2-yl)butan-1-amine
PubChem CID61334636
Molecular FormulaC15H28N2S
Molecular Weight268.47 g/mol
Exact Mass268.20
IUPAC Name2-ethyl-N-propan-2-yl-1-(4-propan-2-yl-1,3-thiazol-2-yl)butan-1-amine
SMILESCCC(CC)C(NC(C)C)c1nc(C(C)C)cs1
InChIInChI=1S/C15H28N2S/c1-7-12(8-2)14(16-11(5)6)15-17-13(9-18-15)10(3)4/h9-12,14,16H,7-8H2,1-6H3
InChIKeyFCXFXNHAMQCWRX-UHFFFAOYSA-N
XLogP4.74
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.47
LogP ≤ 54.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-propan-2-yl-1-(4-propan-2-yl-1,3-thiazol-2-yl)propan-1-amine
CID 61333650
3-ethylsulfanyl-N-propan-2-yl-1-(4-propan-2-yl-1,3-thiazol-2-yl)propan-1-amine
CID 116504477
N-[(4-ethylphenyl)-(4-propan-2-yl-1,3-thiazol-2-yl)methyl]propan-2-amine
CID 61334433
N-(2-methoxyethyl)-2-methyl-1-(4-propan-2-yl-1,3-thiazol-2-yl)butan-1-amine
CID 62544276
N-ethyl-2-phenyl-1-(4-propan-2-yl-1,3-thiazol-2-yl)propan-1-amine
CID 61331441
N-[(4-propan-2-yl-1,3-thiazol-2-yl)-thiophen-2-ylmethyl]propan-2-amine
CID 61347725
2-(3-methylheptan-4-yl)-4-propan-2-yl-1,3-thiazole
CID 123588816
N-[(3-ethylimidazol-4-yl)-(4-propan-2-yl-1,3-thiazol-2-yl)methyl]propan-2-amine
CID 66133298
N-methyl-1-(4-propan-2-yl-1,3-thiazol-2-yl)octan-1-amine
CID 61330560
N-ethyl-1-(4-propan-2-yl-1,3-thiazol-2-yl)pentan-1-amine
CID 61331622
N-pentan-3-yl-4-propan-2-yl-1,3-thiazol-2-amine
CID 58745672
N-[(4-propan-2-yl-1,3-thiazol-2-yl)-pyridin-3-ylmethyl]propan-2-amine
CID 61336198

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-propan-2-yl-1-(4-propan-2-yl-1,3-thiazol-2-yl)butan-1-amine?
The IUPAC name of 2-ethyl-N-propan-2-yl-1-(4-propan-2-yl-1,3-thiazol-2-yl)butan-1-amine (CID 61334636) is 2-ethyl-N-propan-2-yl-1-(4-propan-2-yl-1,3-thiazol-2-yl)butan-1-amine.
What is the SMILES notation for 2-ethyl-N-propan-2-yl-1-(4-propan-2-yl-1,3-thiazol-2-yl)butan-1-amine?
The canonical SMILES for 2-ethyl-N-propan-2-yl-1-(4-propan-2-yl-1,3-thiazol-2-yl)butan-1-amine is CCC(CC)C(NC(C)C)c1nc(C(C)C)cs1.
What is the InChIKey of 2-ethyl-N-propan-2-yl-1-(4-propan-2-yl-1,3-thiazol-2-yl)butan-1-amine?
The InChIKey is FCXFXNHAMQCWRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2S/c1-7-12(8-2)14(16-11(5)6)15-17-13(9-18-15)10(3)4/h9-12,14,16H,7-8H2,1-6H3.
What are the key properties of 2-ethyl-N-propan-2-yl-1-(4-propan-2-yl-1,3-thiazol-2-yl)butan-1-amine?
2-ethyl-N-propan-2-yl-1-(4-propan-2-yl-1,3-thiazol-2-yl)butan-1-amine has a molecular weight of 268.47 g/mol, XLogP of 4.74, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-propan-2-yl-1-(4-propan-2-yl-1,3-thiazol-2-yl)butan-1-amine is sourced from PubChem (CID 61334636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).