N-(2,3-dihydro-1,3-thiazol-4-ylmethyl)-N-methylpropanamide

C8H14N2OS — CID 129309953

IUPACN-(2,3-dihydro-1,3-thiazol-4-ylmethyl)-N-methylpropanamide
SMILESCCC(=O)N(C)CC1=CSCN1
InChIInChI=1S/C8H14N2OS/c1-3-8(11)10(2)4-7-5-12-6-9-7/h5,9H,3-4,6H2,1-2H3
InChIKeyJALBQOFDTPFXON-UHFFFAOYSA-N
MW186.28 g/mol
LogP0.99
Rot. Bonds3

About N-(2,3-dihydro-1,3-thiazol-4-ylmethyl)-N-methylpropanamide

N-(2,3-dihydro-1,3-thiazol-4-ylmethyl)-N-methylpropanamide (PubChem CID 129309953) has the molecular formula C8H14N2OS and a molecular weight of 186.28 g/mol. Its IUPAC name is N-(2,3-dihydro-1,3-thiazol-4-ylmethyl)-N-methylpropanamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1,3-thiazol-4-ylmethyl)-N-methylpropanamide
PubChem CID129309953
Molecular FormulaC8H14N2OS
Molecular Weight186.28 g/mol
Exact Mass186.08
IUPAC NameN-(2,3-dihydro-1,3-thiazol-4-ylmethyl)-N-methylpropanamide
SMILESCCC(=O)N(C)CC1=CSCN1
InChIInChI=1S/C8H14N2OS/c1-3-8(11)10(2)4-7-5-12-6-9-7/h5,9H,3-4,6H2,1-2H3
InChIKeyJALBQOFDTPFXON-UHFFFAOYSA-N
XLogP0.99
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.28
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-ethylphenyl)methyl]-N-methylpropanamide
CID 60630863
ethane;2-[methyl(propanoyl)amino]acetic acid
CID 170570723
ethane;N-(2-hydroxyethyl)-N-methylpropanamide
CID 143051262
N-[(2-methoxyphenyl)methyl]-N-methylpropanamide
CID 60630949
bis(N-ethyl-N-methylpropanamide);pentan-3-one
CID 158092722
N-[(1,3-dimethyl-2,4-dioxopyrimidin-5-yl)methyl]-N-methylpropanamide
CID 64590695
N-[1-(ethylamino)ethyl]-N-methylpropanamide
CID 139891854
N-(2-hydroxypropyl)-N-methylpropanamide
CID 18720717
N-methyl-N-[[2-(morpholin-4-ylmethyl)-1,3-thiazol-4-yl]methyl]propanamide
CID 108746674
N-[(5-butyl-2-chlorophenyl)methyl]-N-methylpropanamide
CID 171836451
N-[(5-chlorothiophen-2-yl)methyl]-N-methyl-3-oxobutanamide
CID 60951660
N-methyl-N-pyridin-4-ylpropanamide
CID 59710602

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1,3-thiazol-4-ylmethyl)-N-methylpropanamide?
The IUPAC name of N-(2,3-dihydro-1,3-thiazol-4-ylmethyl)-N-methylpropanamide (CID 129309953) is N-(2,3-dihydro-1,3-thiazol-4-ylmethyl)-N-methylpropanamide.
What is the SMILES notation for N-(2,3-dihydro-1,3-thiazol-4-ylmethyl)-N-methylpropanamide?
The canonical SMILES for N-(2,3-dihydro-1,3-thiazol-4-ylmethyl)-N-methylpropanamide is CCC(=O)N(C)CC1=CSCN1.
What is the InChIKey of N-(2,3-dihydro-1,3-thiazol-4-ylmethyl)-N-methylpropanamide?
The InChIKey is JALBQOFDTPFXON-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2OS/c1-3-8(11)10(2)4-7-5-12-6-9-7/h5,9H,3-4,6H2,1-2H3.
What are the key properties of N-(2,3-dihydro-1,3-thiazol-4-ylmethyl)-N-methylpropanamide?
N-(2,3-dihydro-1,3-thiazol-4-ylmethyl)-N-methylpropanamide has a molecular weight of 186.28 g/mol, XLogP of 0.99, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1,3-thiazol-4-ylmethyl)-N-methylpropanamide is sourced from PubChem (CID 129309953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).