N-[4-[(1-hydroxycyclopentanecarbonyl)amino]phenyl]thiophene-2-carboxamide

C17H18N2O3S — CID 110911583

IUPACN-[4-[(1-hydroxycyclopentanecarbonyl)amino]phenyl]thiophene-2-carboxamide
SMILESO=C(Nc1ccc(NC(=O)C2(O)CCCC2)cc1)c1cccs1
InChIInChI=1S/C17H18N2O3S/c20-15(14-4-3-11-23-14)18-12-5-7-13(8-6-12)19-16(21)17(22)9-1-2-10-17/h3-8,11,22H,1-2,9-10H2,(H,18,20)(H,19,21)
InChIKeyRGIUHCDPMAAZGL-UHFFFAOYSA-N
MW330.41 g/mol
LogP3.24
Rot. Bonds4

About N-[4-[(1-hydroxycyclopentanecarbonyl)amino]phenyl]thiophene-2-carboxamide

N-[4-[(1-hydroxycyclopentanecarbonyl)amino]phenyl]thiophene-2-carboxamide (PubChem CID 110911583) has the molecular formula C17H18N2O3S and a molecular weight of 330.41 g/mol. Its IUPAC name is N-[4-[(1-hydroxycyclopentanecarbonyl)amino]phenyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[4-[(1-hydroxycyclopentanecarbonyl)amino]phenyl]thiophene-2-carboxamide
PubChem CID110911583
Molecular FormulaC17H18N2O3S
Molecular Weight330.41 g/mol
Exact Mass330.10
IUPAC NameN-[4-[(1-hydroxycyclopentanecarbonyl)amino]phenyl]thiophene-2-carboxamide
SMILESO=C(Nc1ccc(NC(=O)C2(O)CCCC2)cc1)c1cccs1
InChIInChI=1S/C17H18N2O3S/c20-15(14-4-3-11-23-14)18-12-5-7-13(8-6-12)19-16(21)17(22)9-1-2-10-17/h3-8,11,22H,1-2,9-10H2,(H,18,20)(H,19,21)
InChIKeyRGIUHCDPMAAZGL-UHFFFAOYSA-N
XLogP3.24
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.41
LogP ≤ 53.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-[(1-aminocyclohexanecarbonyl)amino]phenyl]thiophene-2-carboxamide
CID 119309327
N-[4-[[1-(4-methylphenyl)cyclopentanecarbonyl]amino]phenyl]thiophene-2-carboxamide
CID 25239450
N-[4-[4-(thiophene-2-carbonylamino)anilino]phenyl]thiophene-2-carboxamide
CID 67687159
N-[4-(hydroxymethyl)phenyl]thiophene-2-carboxamide
CID 64792647
N-(4-sulfanylphenyl)thiophene-2-carboxamide
CID 27126639
N-[4-(cyclohexylamino)phenyl]thiophene-2-carboxamide
CID 112980718
N-[4-[3-(1-aminocyclopentyl)-1,2,4-oxadiazol-5-yl]phenyl]thiophene-2-carboxamide;hydrochloride
CID 120855011
N-(4-acetylphenyl)thiophene-2-carboxamide
CID 573780
N-[4-[(thiophene-2-carbonylamino)carbamoyl]phenyl]thiophene-2-carboxamide
CID 1117998
N-[4-(cyanomethyl)phenyl]thiophene-2-carboxamide
CID 574246
N-(2-oxospiro[1H-indole-3,1'-cyclopentane]-5-yl)thiophene-2-carboxamide
CID 110405577
N-[4-(piperidine-1-carbonyl)phenyl]thiophene-2-carboxamide
CID 761867

Frequently Asked Questions

What is the IUPAC name of N-[4-[(1-hydroxycyclopentanecarbonyl)amino]phenyl]thiophene-2-carboxamide?
The IUPAC name of N-[4-[(1-hydroxycyclopentanecarbonyl)amino]phenyl]thiophene-2-carboxamide (CID 110911583) is N-[4-[(1-hydroxycyclopentanecarbonyl)amino]phenyl]thiophene-2-carboxamide.
What is the SMILES notation for N-[4-[(1-hydroxycyclopentanecarbonyl)amino]phenyl]thiophene-2-carboxamide?
The canonical SMILES for N-[4-[(1-hydroxycyclopentanecarbonyl)amino]phenyl]thiophene-2-carboxamide is O=C(Nc1ccc(NC(=O)C2(O)CCCC2)cc1)c1cccs1.
What is the InChIKey of N-[4-[(1-hydroxycyclopentanecarbonyl)amino]phenyl]thiophene-2-carboxamide?
The InChIKey is RGIUHCDPMAAZGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O3S/c20-15(14-4-3-11-23-14)18-12-5-7-13(8-6-12)19-16(21)17(22)9-1-2-10-17/h3-8,11,22H,1-2,9-10H2,(H,18,20)(H,19,21).
What are the key properties of N-[4-[(1-hydroxycyclopentanecarbonyl)amino]phenyl]thiophene-2-carboxamide?
N-[4-[(1-hydroxycyclopentanecarbonyl)amino]phenyl]thiophene-2-carboxamide has a molecular weight of 330.41 g/mol, XLogP of 3.24, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(1-hydroxycyclopentanecarbonyl)amino]phenyl]thiophene-2-carboxamide is sourced from PubChem (CID 110911583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).