N-(5-propyl-1,3-thiazol-2-yl)propanamide

C9H14N2OS — CID 19029488

IUPACN-(5-propyl-1,3-thiazol-2-yl)propanamide
SMILESCCCc1cnc(NC(=O)CC)s1
InChIInChI=1S/C9H14N2OS/c1-3-5-7-6-10-9(13-7)11-8(12)4-2/h6H,3-5H2,1-2H3,(H,10,11,12)
InChIKeyNRQOBKRVFSNEPX-UHFFFAOYSA-N
MW198.29 g/mol
LogP2.44
Rot. Bonds4

About N-(5-propyl-1,3-thiazol-2-yl)propanamide

N-(5-propyl-1,3-thiazol-2-yl)propanamide (PubChem CID 19029488) has the molecular formula C9H14N2OS and a molecular weight of 198.29 g/mol. Its IUPAC name is N-(5-propyl-1,3-thiazol-2-yl)propanamide.

Molecular Properties

Compound NameN-(5-propyl-1,3-thiazol-2-yl)propanamide
PubChem CID19029488
Molecular FormulaC9H14N2OS
Molecular Weight198.29 g/mol
Exact Mass198.08
IUPAC NameN-(5-propyl-1,3-thiazol-2-yl)propanamide
SMILESCCCc1cnc(NC(=O)CC)s1
InChIInChI=1S/C9H14N2OS/c1-3-5-7-6-10-9(13-7)11-8(12)4-2/h6H,3-5H2,1-2H3,(H,10,11,12)
InChIKeyNRQOBKRVFSNEPX-UHFFFAOYSA-N
XLogP2.44
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.29
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 44396116
5-Propyl-1,3-thiazol-2-amine
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CID 298507
N-[5-(cyclohexylmethyl)thiazol-2-yl]-2-methyl-propanamide
CID 118726220
N-(5-ethyl-1,3-thiazol-2-yl)cyclohexanecarboxamide
CID 145969358
3-cyclohexyl-N-(5-ethyl-1,3-thiazol-2-yl)propanamide
CID 145970464
N-(5-(1,1-Dimethylethyl)-2-thiazolyl)acetamide
CID 842040
N-[5-(2-methylbutan-2-yl)-1,3-thiazol-2-yl]acetamide
CID 2305534
4-methyl-N-(5-methyl-1,3-thiazol-2-yl)pentanamide
CID 25661258
N-(5-ethyl-1,3-thiazol-2-yl)-3-(2,2,2-trifluoroethoxy)propanamide
CID 71994018
4-ethoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)butanamide
CID 71999021
1-[2-(Dimethylamino)ethyl]-3-[5-(2-methylpropyl)-1,3-thiazol-2-yl]urea
CID 75500154

Frequently Asked Questions

What is the IUPAC name of N-(5-propyl-1,3-thiazol-2-yl)propanamide?
The IUPAC name of N-(5-propyl-1,3-thiazol-2-yl)propanamide (CID 19029488) is N-(5-propyl-1,3-thiazol-2-yl)propanamide.
What is the SMILES notation for N-(5-propyl-1,3-thiazol-2-yl)propanamide?
The canonical SMILES for N-(5-propyl-1,3-thiazol-2-yl)propanamide is CCCc1cnc(NC(=O)CC)s1.
What is the InChIKey of N-(5-propyl-1,3-thiazol-2-yl)propanamide?
The InChIKey is NRQOBKRVFSNEPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2OS/c1-3-5-7-6-10-9(13-7)11-8(12)4-2/h6H,3-5H2,1-2H3,(H,10,11,12).
What are the key properties of N-(5-propyl-1,3-thiazol-2-yl)propanamide?
N-(5-propyl-1,3-thiazol-2-yl)propanamide has a molecular weight of 198.29 g/mol, XLogP of 2.44, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-propyl-1,3-thiazol-2-yl)propanamide is sourced from PubChem (CID 19029488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).