N-(4-hydroxypentyl)thiophene-3-carboxamide

C10H15NO2S — CID 107299586

IUPACN-(4-hydroxypentyl)thiophene-3-carboxamide
SMILESCC(O)CCCNC(=O)c1ccsc1
InChIInChI=1S/C10H15NO2S/c1-8(12)3-2-5-11-10(13)9-4-6-14-7-9/h4,6-8,12H,2-3,5H2,1H3,(H,11,13)
InChIKeyCZYRXCNAFAIODF-UHFFFAOYSA-N
MW213.30 g/mol
LogP1.64
Rot. Bonds5

About N-(4-hydroxypentyl)thiophene-3-carboxamide

N-(4-hydroxypentyl)thiophene-3-carboxamide (PubChem CID 107299586) has the molecular formula C10H15NO2S and a molecular weight of 213.30 g/mol. Its IUPAC name is N-(4-hydroxypentyl)thiophene-3-carboxamide.

Molecular Properties

Compound NameN-(4-hydroxypentyl)thiophene-3-carboxamide
PubChem CID107299586
Molecular FormulaC10H15NO2S
Molecular Weight213.30 g/mol
Exact Mass213.08
IUPAC NameN-(4-hydroxypentyl)thiophene-3-carboxamide
SMILESCC(O)CCCNC(=O)c1ccsc1
InChIInChI=1S/C10H15NO2S/c1-8(12)3-2-5-11-10(13)9-4-6-14-7-9/h4,6-8,12H,2-3,5H2,1H3,(H,11,13)
InChIKeyCZYRXCNAFAIODF-UHFFFAOYSA-N
XLogP1.64
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.30
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[4-(3-hydroxybutylamino)-4-oxobutyl]thiophene-3-carboxamide
CID 111429071
N-[2-(thiophene-3-carbonylamino)ethyl]thiophene-3-carboxamide
CID 101004058
4-hydroxy-N-(4-hydroxypentyl)benzamide
CID 107300182
N-[3-(3-methylbutan-2-ylamino)-3-oxopropyl]thiophene-3-carboxamide
CID 43043343
N-[4-(1-hydroxypropan-2-ylamino)-4-oxobutyl]thiophene-3-carboxamide
CID 110887400
N-[3-(5-methylhexan-2-ylamino)-3-oxopropyl]thiophene-3-carboxamide
CID 78803837
4-(dimethylamino)-N-(4-hydroxypentyl)benzamide
CID 107329726
N-[2-[[(2S)-butan-2-yl]-methylamino]ethyl]thiophene-3-carboxamide
CID 95167795
N-[4-(1-methoxypropan-2-ylamino)-4-oxobutyl]thiophene-3-carboxamide
CID 18161073
N-[2-(propylamino)ethyl]thiophene-3-carboxamide
CID 62658821
3,5-diamino-N-(4-hydroxypentyl)benzamide
CID 114145961
N-[2-(diethylamino)ethyl]thiophene-3-carboxamide
CID 47007987

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxypentyl)thiophene-3-carboxamide?
The IUPAC name of N-(4-hydroxypentyl)thiophene-3-carboxamide (CID 107299586) is N-(4-hydroxypentyl)thiophene-3-carboxamide.
What is the SMILES notation for N-(4-hydroxypentyl)thiophene-3-carboxamide?
The canonical SMILES for N-(4-hydroxypentyl)thiophene-3-carboxamide is CC(O)CCCNC(=O)c1ccsc1.
What is the InChIKey of N-(4-hydroxypentyl)thiophene-3-carboxamide?
The InChIKey is CZYRXCNAFAIODF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2S/c1-8(12)3-2-5-11-10(13)9-4-6-14-7-9/h4,6-8,12H,2-3,5H2,1H3,(H,11,13).
What are the key properties of N-(4-hydroxypentyl)thiophene-3-carboxamide?
N-(4-hydroxypentyl)thiophene-3-carboxamide has a molecular weight of 213.30 g/mol, XLogP of 1.64, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxypentyl)thiophene-3-carboxamide is sourced from PubChem (CID 107299586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).