5-ethyl-N-[(1-hydroxy-4-methylcyclohexyl)methyl]thiophene-2-carboxamide

C15H23NO2S — CID 65119545

IUPAC5-ethyl-N-[(1-hydroxy-4-methylcyclohexyl)methyl]thiophene-2-carboxamide
SMILESCCc1ccc(C(=O)NCC2(O)CCC(C)CC2)s1
InChIInChI=1S/C15H23NO2S/c1-3-12-4-5-13(19-12)14(17)16-10-15(18)8-6-11(2)7-9-15/h4-5,11,18H,3,6-10H2,1-2H3,(H,16,17)
InChIKeyBXRIYRVBPCFNGD-UHFFFAOYSA-N
MW281.42 g/mol
LogP2.98
Rot. Bonds4

About 5-ethyl-N-[(1-hydroxy-4-methylcyclohexyl)methyl]thiophene-2-carboxamide

5-ethyl-N-[(1-hydroxy-4-methylcyclohexyl)methyl]thiophene-2-carboxamide (PubChem CID 65119545) has the molecular formula C15H23NO2S and a molecular weight of 281.42 g/mol. Its IUPAC name is 5-ethyl-N-[(1-hydroxy-4-methylcyclohexyl)methyl]thiophene-2-carboxamide.

Molecular Properties

Compound Name5-ethyl-N-[(1-hydroxy-4-methylcyclohexyl)methyl]thiophene-2-carboxamide
PubChem CID65119545
Molecular FormulaC15H23NO2S
Molecular Weight281.42 g/mol
Exact Mass281.14
IUPAC Name5-ethyl-N-[(1-hydroxy-4-methylcyclohexyl)methyl]thiophene-2-carboxamide
SMILESCCc1ccc(C(=O)NCC2(O)CCC(C)CC2)s1
InChIInChI=1S/C15H23NO2S/c1-3-12-4-5-13(19-12)14(17)16-10-15(18)8-6-11(2)7-9-15/h4-5,11,18H,3,6-10H2,1-2H3,(H,16,17)
InChIKeyBXRIYRVBPCFNGD-UHFFFAOYSA-N
XLogP2.98
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.42
LogP ≤ 52.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1-hydroxy-4-methylcyclohexyl)methyl]-5-methylthiophene-2-carboxamide
CID 65118919
5-ethyl-N-[(3-methyloxetan-3-yl)methyl]thiophene-2-carboxamide
CID 78957474
4-hydroxy-N-[(1-hydroxy-4-methylcyclohexyl)methyl]benzamide
CID 65119060
N-[(1-hydroxy-4-methylcyclohexyl)methyl]-4-methoxybenzamide
CID 65119825
2,5-dibromo-N-[(1-hydroxy-4-methylcyclohexyl)methyl]thiophene-3-carboxamide
CID 107962266
N-(2-cyclopropyl-2-hydroxyethyl)-5-ethylthiophene-2-carboxamide
CID 63298785
3-chloro-N-[(1-hydroxy-4-methylcyclohexyl)methyl]thiophene-2-carboxamide
CID 80642461
3,6-dichloro-N-[(1-hydroxy-4-methylcyclohexyl)methyl]pyridine-2-carboxamide
CID 65118546
5-(cyclopropanecarbonylamino)-N-[(1-hydroxycyclobutyl)methyl]thiophene-2-carboxamide
CID 115668905
N-[(1-hydroxy-4-methylcyclohexyl)methyl]-2,4,6-trimethylbenzamide
CID 65120092
2-chloro-5-hydroxy-N-[(1-hydroxy-4-methylcyclohexyl)methyl]benzamide
CID 106502468
N-[(1-hydroxy-4-methylcyclohexyl)methyl]-1H-pyrazole-5-carboxamide
CID 65119924

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-[(1-hydroxy-4-methylcyclohexyl)methyl]thiophene-2-carboxamide?
The IUPAC name of 5-ethyl-N-[(1-hydroxy-4-methylcyclohexyl)methyl]thiophene-2-carboxamide (CID 65119545) is 5-ethyl-N-[(1-hydroxy-4-methylcyclohexyl)methyl]thiophene-2-carboxamide.
What is the SMILES notation for 5-ethyl-N-[(1-hydroxy-4-methylcyclohexyl)methyl]thiophene-2-carboxamide?
The canonical SMILES for 5-ethyl-N-[(1-hydroxy-4-methylcyclohexyl)methyl]thiophene-2-carboxamide is CCc1ccc(C(=O)NCC2(O)CCC(C)CC2)s1.
What is the InChIKey of 5-ethyl-N-[(1-hydroxy-4-methylcyclohexyl)methyl]thiophene-2-carboxamide?
The InChIKey is BXRIYRVBPCFNGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2S/c1-3-12-4-5-13(19-12)14(17)16-10-15(18)8-6-11(2)7-9-15/h4-5,11,18H,3,6-10H2,1-2H3,(H,16,17).
What are the key properties of 5-ethyl-N-[(1-hydroxy-4-methylcyclohexyl)methyl]thiophene-2-carboxamide?
5-ethyl-N-[(1-hydroxy-4-methylcyclohexyl)methyl]thiophene-2-carboxamide has a molecular weight of 281.42 g/mol, XLogP of 2.98, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-[(1-hydroxy-4-methylcyclohexyl)methyl]thiophene-2-carboxamide is sourced from PubChem (CID 65119545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).