2-(dimethylamino)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pentanamide

C13H23N3OS — CID 71905849

IUPAC2-(dimethylamino)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pentanamide
SMILESCCCC(C(=O)NCCc1nc(C)cs1)N(C)C
InChIInChI=1S/C13H23N3OS/c1-5-6-11(16(3)4)13(17)14-8-7-12-15-10(2)9-18-12/h9,11H,5-8H2,1-4H3,(H,14,17)
InChIKeyFEQYEBSCUVWNIE-UHFFFAOYSA-N
MW269.41 g/mol
LogP1.84
Rot. Bonds7

About 2-(dimethylamino)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pentanamide

2-(dimethylamino)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pentanamide (PubChem CID 71905849) has the molecular formula C13H23N3OS and a molecular weight of 269.41 g/mol. Its IUPAC name is 2-(dimethylamino)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pentanamide.

Molecular Properties

Compound Name2-(dimethylamino)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pentanamide
PubChem CID71905849
Molecular FormulaC13H23N3OS
Molecular Weight269.41 g/mol
Exact Mass269.16
IUPAC Name2-(dimethylamino)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pentanamide
SMILESCCCC(C(=O)NCCc1nc(C)cs1)N(C)C
InChIInChI=1S/C13H23N3OS/c1-5-6-11(16(3)4)13(17)14-8-7-12-15-10(2)9-18-12/h9,11H,5-8H2,1-4H3,(H,14,17)
InChIKeyFEQYEBSCUVWNIE-UHFFFAOYSA-N
XLogP1.84
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.41
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pentanamide?
The IUPAC name of 2-(dimethylamino)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pentanamide (CID 71905849) is 2-(dimethylamino)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pentanamide.
What is the SMILES notation for 2-(dimethylamino)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pentanamide?
The canonical SMILES for 2-(dimethylamino)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pentanamide is CCCC(C(=O)NCCc1nc(C)cs1)N(C)C.
What is the InChIKey of 2-(dimethylamino)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pentanamide?
The InChIKey is FEQYEBSCUVWNIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3OS/c1-5-6-11(16(3)4)13(17)14-8-7-12-15-10(2)9-18-12/h9,11H,5-8H2,1-4H3,(H,14,17).
What are the key properties of 2-(dimethylamino)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pentanamide?
2-(dimethylamino)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pentanamide has a molecular weight of 269.41 g/mol, XLogP of 1.84, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pentanamide is sourced from PubChem (CID 71905849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).