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

C14H26N2S — CID 61333805

IUPAC2-(4-propan-2-yl-1,3-thiazol-2-yl)-N-propylpentan-2-amine
SMILESCCCNC(C)(CCC)c1nc(C(C)C)cs1
InChIInChI=1S/C14H26N2S/c1-6-8-14(5,15-9-7-2)13-16-12(10-17-13)11(3)4/h10-11,15H,6-9H2,1-5H3
InChIKeyFOYWDOMYKXFERF-UHFFFAOYSA-N
MW254.44 g/mol
LogP4.28
Rot. Bonds7

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

2-(4-propan-2-yl-1,3-thiazol-2-yl)-N-propylpentan-2-amine (PubChem CID 61333805) has the molecular formula C14H26N2S and a molecular weight of 254.44 g/mol. Its IUPAC name is 2-(4-propan-2-yl-1,3-thiazol-2-yl)-N-propylpentan-2-amine.

Molecular Properties

Compound Name2-(4-propan-2-yl-1,3-thiazol-2-yl)-N-propylpentan-2-amine
PubChem CID61333805
Molecular FormulaC14H26N2S
Molecular Weight254.44 g/mol
Exact Mass254.18
IUPAC Name2-(4-propan-2-yl-1,3-thiazol-2-yl)-N-propylpentan-2-amine
SMILESCCCNC(C)(CCC)c1nc(C(C)C)cs1
InChIInChI=1S/C14H26N2S/c1-6-8-14(5,15-9-7-2)13-16-12(10-17-13)11(3)4/h10-11,15H,6-9H2,1-5H3
InChIKeyFOYWDOMYKXFERF-UHFFFAOYSA-N
XLogP4.28
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.44
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-propan-2-yl-1,3-thiazol-2-yl)-N-propylpentan-2-amine?
The IUPAC name of 2-(4-propan-2-yl-1,3-thiazol-2-yl)-N-propylpentan-2-amine (CID 61333805) is 2-(4-propan-2-yl-1,3-thiazol-2-yl)-N-propylpentan-2-amine.
What is the SMILES notation for 2-(4-propan-2-yl-1,3-thiazol-2-yl)-N-propylpentan-2-amine?
The canonical SMILES for 2-(4-propan-2-yl-1,3-thiazol-2-yl)-N-propylpentan-2-amine is CCCNC(C)(CCC)c1nc(C(C)C)cs1.
What is the InChIKey of 2-(4-propan-2-yl-1,3-thiazol-2-yl)-N-propylpentan-2-amine?
The InChIKey is FOYWDOMYKXFERF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2S/c1-6-8-14(5,15-9-7-2)13-16-12(10-17-13)11(3)4/h10-11,15H,6-9H2,1-5H3.
What are the key properties of 2-(4-propan-2-yl-1,3-thiazol-2-yl)-N-propylpentan-2-amine?
2-(4-propan-2-yl-1,3-thiazol-2-yl)-N-propylpentan-2-amine has a molecular weight of 254.44 g/mol, XLogP of 4.28, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-propan-2-yl-1,3-thiazol-2-yl)-N-propylpentan-2-amine is sourced from PubChem (CID 61333805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).