N-hydroxy-5-[5-[(2-phenoxyethylamino)methyl]-2-pyridinyl]thiophene-2-carboxamide

C19H19N3O3S — CID 11696355

IUPACN-hydroxy-5-[5-[(2-phenoxyethylamino)methyl]-2-pyridinyl]thiophene-2-carboxamide
SMILESO=C(NO)c1ccc(-c2ccc(CNCCOc3ccccc3)cn2)s1
InChIInChI=1S/C19H19N3O3S/c23-19(22-24)18-9-8-17(26-18)16-7-6-14(13-21-16)12-20-10-11-25-15-4-2-1-3-5-15/h1-9,13,20,24H,10-12H2,(H,22,23)
InChIKeyKARJWFQZRRZWOM-UHFFFAOYSA-N
MW369.45 g/mol
LogP3.10
Rot. Bonds8

About N-hydroxy-5-[5-[(2-phenoxyethylamino)methyl]-2-pyridinyl]thiophene-2-carboxamide

N-hydroxy-5-[5-[(2-phenoxyethylamino)methyl]-2-pyridinyl]thiophene-2-carboxamide (PubChem CID 11696355) has the molecular formula C19H19N3O3S and a molecular weight of 369.45 g/mol. Its IUPAC name is N-hydroxy-5-[5-[(2-phenoxyethylamino)methyl]-2-pyridinyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-hydroxy-5-[5-[(2-phenoxyethylamino)methyl]-2-pyridinyl]thiophene-2-carboxamide
PubChem CID11696355
Molecular FormulaC19H19N3O3S
Molecular Weight369.45 g/mol
Exact Mass369.11
IUPAC NameN-hydroxy-5-[5-[(2-phenoxyethylamino)methyl]-2-pyridinyl]thiophene-2-carboxamide
SMILESO=C(NO)c1ccc(-c2ccc(CNCCOc3ccccc3)cn2)s1
InChIInChI=1S/C19H19N3O3S/c23-19(22-24)18-9-8-17(26-18)16-7-6-14(13-21-16)12-20-10-11-25-15-4-2-1-3-5-15/h1-9,13,20,24H,10-12H2,(H,22,23)
InChIKeyKARJWFQZRRZWOM-UHFFFAOYSA-N
XLogP3.10
TPSA83.48 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.45
LogP ≤ 53.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(2-quinolin-8-yloxyethyl)thiophene-2-carboxamide
CID 1811238
N-pyridin-3-yl-4H-thieno[3,2-c]chromene-2-carboxamide
CID 20877944
1-(5-(4-(2-(Diethylamino)ethoxy)phenyl)-3-(pyridin-3-ylcarbamoyl)thiophen-2-yl)urea
CID 11648145
5-[[3-(1-Benzothiophene-2-carbonylamino)phenyl]methoxy]pyridine-3-carboxamide
CID 124155947
N-[3-[(5-carbamoyl-3-pyridinyl)oxymethyl]phenyl]-6-thiophen-2-ylpyridine-3-carboxamide
CID 124156389
5-[[3-(Thiophene-2-carbonylamino)phenyl]methoxy]pyridine-3-carboxamide
CID 124156582
5-[[3-[(4-Thiophen-2-ylbenzoyl)amino]phenyl]methoxy]pyridine-3-carboxamide
CID 124157054
6-[4-[(2-Thiophen-2-ylethylamino)methyl]phenoxy]pyridine-3-carboxamide
CID 68746483
2-((Phenoxyacetyl)amino)-N-(3-pyridinylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
CID 2181154
N-(4-ethoxyphenyl)-2-(pyridin-3-ylmethylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
CID 3364511
3-hydroxy-5-(3-propoxyphenyl)-1-(pyridin-3-ylmethyl)-4-(thiophene-2-carbonyl)-1H-pyrrol-2(5H)-one
CID 3502624
5-(3-butoxyphenyl)-3-hydroxy-1-(3-pyridinylmethyl)-4-(2-thienylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
CID 3545131

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-5-[5-[(2-phenoxyethylamino)methyl]-2-pyridinyl]thiophene-2-carboxamide?
The IUPAC name of N-hydroxy-5-[5-[(2-phenoxyethylamino)methyl]-2-pyridinyl]thiophene-2-carboxamide (CID 11696355) is N-hydroxy-5-[5-[(2-phenoxyethylamino)methyl]-2-pyridinyl]thiophene-2-carboxamide.
What is the SMILES notation for N-hydroxy-5-[5-[(2-phenoxyethylamino)methyl]-2-pyridinyl]thiophene-2-carboxamide?
The canonical SMILES for N-hydroxy-5-[5-[(2-phenoxyethylamino)methyl]-2-pyridinyl]thiophene-2-carboxamide is O=C(NO)c1ccc(-c2ccc(CNCCOc3ccccc3)cn2)s1.
What is the InChIKey of N-hydroxy-5-[5-[(2-phenoxyethylamino)methyl]-2-pyridinyl]thiophene-2-carboxamide?
The InChIKey is KARJWFQZRRZWOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O3S/c23-19(22-24)18-9-8-17(26-18)16-7-6-14(13-21-16)12-20-10-11-25-15-4-2-1-3-5-15/h1-9,13,20,24H,10-12H2,(H,22,23).
What are the key properties of N-hydroxy-5-[5-[(2-phenoxyethylamino)methyl]-2-pyridinyl]thiophene-2-carboxamide?
N-hydroxy-5-[5-[(2-phenoxyethylamino)methyl]-2-pyridinyl]thiophene-2-carboxamide has a molecular weight of 369.45 g/mol, XLogP of 3.10, 8 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-5-[5-[(2-phenoxyethylamino)methyl]-2-pyridinyl]thiophene-2-carboxamide is sourced from PubChem (CID 11696355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).