4-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide

C10H16N2OS — CID 112794692

IUPAC4-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide
SMILESCC(C)CCC(=O)/N=c1\sccn1C
InChIInChI=1S/C10H16N2OS/c1-8(2)4-5-9(13)11-10-12(3)6-7-14-10/h6-8H,4-5H2,1-3H3/b11-10-
InChIKeyQFWOVKVWJATSPJ-KHPPLWFESA-N
MW212.32 g/mol
LogP1.95
Rot. Bonds3

About 4-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide

4-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide (PubChem CID 112794692) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is 4-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide.

Molecular Properties

Compound Name4-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide
PubChem CID112794692
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC Name4-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide
SMILESCC(C)CCC(=O)/N=c1\sccn1C
InChIInChI=1S/C10H16N2OS/c1-8(2)4-5-9(13)11-10-12(3)6-7-14-10/h6-8H,4-5H2,1-3H3/b11-10-
InChIKeyQFWOVKVWJATSPJ-KHPPLWFESA-N
XLogP1.95
TPSA34.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 51.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-methyl-1,3-thiazol-2-ylidene)butanamide
CID 14442047
2-cyclohexyl-N-(3-methyl-1,3-thiazol-2-ylidene)acetamide
CID 52893962
N-(3-methyl-1,3-thiazol-2-ylidene)cyclopentanecarboxamide
CID 52893970
3,3-Dimethyl-N-(3-methylthiazol-2(3H)-ylidene)butanamide
CID 52893971
(2R)-2-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide
CID 52893975
(2S)-2-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide
CID 52893976
2-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide
CID 53531972
3-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)hexanamide
CID 56255550
2-ethyl-N-(3-methyl-1,3-thiazol-2-ylidene)butanamide
CID 78773264
N-(3-methyl-1,3-thiazol-2-ylidene)cyclohexanecarboxamide
CID 112794710
N-(3-methyl-1,3-thiazol-2-ylidene)hexanamide
CID 112794711
2-cyclopentyl-N-(3-methyl-1,3-thiazol-2-ylidene)acetamide
CID 112794712

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide?
The IUPAC name of 4-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide (CID 112794692) is 4-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide.
What is the SMILES notation for 4-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide?
The canonical SMILES for 4-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide is CC(C)CCC(=O)/N=c1\sccn1C.
What is the InChIKey of 4-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide?
The InChIKey is QFWOVKVWJATSPJ-KHPPLWFESA-N. The full InChI is InChI=1S/C10H16N2OS/c1-8(2)4-5-9(13)11-10-12(3)6-7-14-10/h6-8H,4-5H2,1-3H3/b11-10-.
What are the key properties of 4-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide?
4-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide has a molecular weight of 212.32 g/mol, XLogP of 1.95, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide is sourced from PubChem (CID 112794692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).