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

C11H18N2OS — CID 39071897

IUPACN-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pentanamide
SMILESCCCCC(=O)NCCc1nc(C)cs1
InChIInChI=1S/C11H18N2OS/c1-3-4-5-10(14)12-7-6-11-13-9(2)8-15-11/h8H,3-7H2,1-2H3,(H,12,14)
InChIKeyFLMLNDSYRXYJRM-UHFFFAOYSA-N
MW226.34 g/mol
LogP2.30
Rot. Bonds6

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

N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pentanamide (PubChem CID 39071897) has the molecular formula C11H18N2OS and a molecular weight of 226.34 g/mol. Its IUPAC name is N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pentanamide.

Molecular Properties

Compound NameN-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pentanamide
PubChem CID39071897
Molecular FormulaC11H18N2OS
Molecular Weight226.34 g/mol
Exact Mass226.11
IUPAC NameN-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pentanamide
SMILESCCCCC(=O)NCCc1nc(C)cs1
InChIInChI=1S/C11H18N2OS/c1-3-4-5-10(14)12-7-6-11-13-9(2)8-15-11/h8H,3-7H2,1-2H3,(H,12,14)
InChIKeyFLMLNDSYRXYJRM-UHFFFAOYSA-N
XLogP2.30
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.34
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-methyl-1,3-thiazol-2-yl)methyl]pentanamide
CID 110739073
2-amino-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]hexanamide
CID 63240116
3-(4-ethylphenyl)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]propanamide
CID 110739218
N-[2-[4-(4-methyl-1,3-thiazol-2-yl)-1,3-thiazol-2-yl]ethyl]butanamide
CID 123185864
2-[2-(heptanoylamino)ethyl]-1,3-thiazole-4-carboxylic acid
CID 66374838
N-butyl-2-(4-methyl-1,3-thiazol-2-yl)acetamide
CID 110484403
N-[2-(4-pyridin-4-yl-1,3-thiazol-2-yl)ethyl]pentanamide
CID 110317749
N-[3-(4-methyl-1,3-thiazol-2-yl)propyl]pent-3-enamide
CID 171145739
1-ethyl-3-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]urea
CID 47228479
N-hexyl-2-(4-methyl-1,3-thiazol-2-yl)acetamide
CID 110484487
1-methyl-3-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]urea
CID 115579398
3-(4-methyl-1,3-thiazol-2-yl)-N-(3-phenylpropyl)propanamide
CID 110388471

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pentanamide?
The IUPAC name of N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pentanamide (CID 39071897) is N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pentanamide.
What is the SMILES notation for N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pentanamide?
The canonical SMILES for N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pentanamide is CCCCC(=O)NCCc1nc(C)cs1.
What is the InChIKey of N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pentanamide?
The InChIKey is FLMLNDSYRXYJRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2OS/c1-3-4-5-10(14)12-7-6-11-13-9(2)8-15-11/h8H,3-7H2,1-2H3,(H,12,14).
What are the key properties of N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pentanamide?
N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pentanamide has a molecular weight of 226.34 g/mol, XLogP of 2.30, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pentanamide is sourced from PubChem (CID 39071897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).