N-[2-(furan-2-yl)-2-hydroxypropyl]-2-propyl-1,3-thiazole-5-carboxamide

C14H18N2O3S — CID 111482118

IUPACN-[2-(furan-2-yl)-2-hydroxypropyl]-2-propyl-1,3-thiazole-5-carboxamide
SMILESCCCc1ncc(C(=O)NCC(C)(O)c2ccco2)s1
InChIInChI=1S/C14H18N2O3S/c1-3-5-12-15-8-10(20-12)13(17)16-9-14(2,18)11-6-4-7-19-11/h4,6-8,18H,3,5,9H2,1-2H3,(H,16,17)
InChIKeyFZZKULVMTRKTRV-UHFFFAOYSA-N
MW294.38 g/mol
LogP2.33
Rot. Bonds6

About N-[2-(furan-2-yl)-2-hydroxypropyl]-2-propyl-1,3-thiazole-5-carboxamide

N-[2-(furan-2-yl)-2-hydroxypropyl]-2-propyl-1,3-thiazole-5-carboxamide (PubChem CID 111482118) has the molecular formula C14H18N2O3S and a molecular weight of 294.38 g/mol. Its IUPAC name is N-[2-(furan-2-yl)-2-hydroxypropyl]-2-propyl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound NameN-[2-(furan-2-yl)-2-hydroxypropyl]-2-propyl-1,3-thiazole-5-carboxamide
PubChem CID111482118
Molecular FormulaC14H18N2O3S
Molecular Weight294.38 g/mol
Exact Mass294.10
IUPAC NameN-[2-(furan-2-yl)-2-hydroxypropyl]-2-propyl-1,3-thiazole-5-carboxamide
SMILESCCCc1ncc(C(=O)NCC(C)(O)c2ccco2)s1
InChIInChI=1S/C14H18N2O3S/c1-3-5-12-15-8-10(20-12)13(17)16-9-14(2,18)11-6-4-7-19-11/h4,6-8,18H,3,5,9H2,1-2H3,(H,16,17)
InChIKeyFZZKULVMTRKTRV-UHFFFAOYSA-N
XLogP2.33
TPSA75.36 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.38
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-hydroxy-2-methyl-3-methylsulfanylpropyl)-2-propyl-1,3-thiazole-5-carboxamide
CID 111463024
N-[2-(furan-2-yl)-2-hydroxypropyl]pyrazine-2-carboxamide
CID 111481899
2,6-dichloro-N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide
CID 71975267
N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide
CID 111482452
N-[2-(furan-2-yl)-2-hydroxypropyl]cyclopropanecarboxamide
CID 71782530
1-[2-(furan-2-yl)-2-hydroxypropyl]-3-(5-methyl-1,3-thiazol-2-yl)urea
CID 111473250
2-chloro-N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide
CID 71782549
N-[2-(furan-2-yl)-2-hydroxypropyl]-1,2-oxazole-5-carboxamide
CID 121085807
N-[2-(furan-2-yl)-2-hydroxypropyl]thiophene-3-carboxamide
CID 71782534
2-chloro-N-[2-(furan-2-yl)-2-hydroxypropyl]pyridine-4-carboxamide
CID 111482264
N-[2-(furan-2-yl)-2-hydroxypropyl]-2-methylpentanamide
CID 111482352
methyl N-[2-(furan-2-yl)-2-hydroxypropyl]carbamate
CID 121085806

Frequently Asked Questions

What is the IUPAC name of N-[2-(furan-2-yl)-2-hydroxypropyl]-2-propyl-1,3-thiazole-5-carboxamide?
The IUPAC name of N-[2-(furan-2-yl)-2-hydroxypropyl]-2-propyl-1,3-thiazole-5-carboxamide (CID 111482118) is N-[2-(furan-2-yl)-2-hydroxypropyl]-2-propyl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for N-[2-(furan-2-yl)-2-hydroxypropyl]-2-propyl-1,3-thiazole-5-carboxamide?
The canonical SMILES for N-[2-(furan-2-yl)-2-hydroxypropyl]-2-propyl-1,3-thiazole-5-carboxamide is CCCc1ncc(C(=O)NCC(C)(O)c2ccco2)s1.
What is the InChIKey of N-[2-(furan-2-yl)-2-hydroxypropyl]-2-propyl-1,3-thiazole-5-carboxamide?
The InChIKey is FZZKULVMTRKTRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O3S/c1-3-5-12-15-8-10(20-12)13(17)16-9-14(2,18)11-6-4-7-19-11/h4,6-8,18H,3,5,9H2,1-2H3,(H,16,17).
What are the key properties of N-[2-(furan-2-yl)-2-hydroxypropyl]-2-propyl-1,3-thiazole-5-carboxamide?
N-[2-(furan-2-yl)-2-hydroxypropyl]-2-propyl-1,3-thiazole-5-carboxamide has a molecular weight of 294.38 g/mol, XLogP of 2.33, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(furan-2-yl)-2-hydroxypropyl]-2-propyl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 111482118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).