N-[3-oxo-3-(2-thiophen-2-ylethylamino)propyl]furan-3-carboxamide

C14H16N2O3S — CID 39931388

IUPACN-[3-oxo-3-(2-thiophen-2-ylethylamino)propyl]furan-3-carboxamide
SMILESO=C(CCNC(=O)c1ccoc1)NCCc1cccs1
InChIInChI=1S/C14H16N2O3S/c17-13(15-6-3-12-2-1-9-20-12)4-7-16-14(18)11-5-8-19-10-11/h1-2,5,8-10H,3-4,6-7H2,(H,15,17)(H,16,18)
InChIKeyNJEPHMHEWHQNSW-UHFFFAOYSA-N
MW292.36 g/mol
LogP1.82
Rot. Bonds7

About N-[3-oxo-3-(2-thiophen-2-ylethylamino)propyl]furan-3-carboxamide

N-[3-oxo-3-(2-thiophen-2-ylethylamino)propyl]furan-3-carboxamide (PubChem CID 39931388) has the molecular formula C14H16N2O3S and a molecular weight of 292.36 g/mol. Its IUPAC name is N-[3-oxo-3-(2-thiophen-2-ylethylamino)propyl]furan-3-carboxamide.

Molecular Properties

Compound NameN-[3-oxo-3-(2-thiophen-2-ylethylamino)propyl]furan-3-carboxamide
PubChem CID39931388
Molecular FormulaC14H16N2O3S
Molecular Weight292.36 g/mol
Exact Mass292.09
IUPAC NameN-[3-oxo-3-(2-thiophen-2-ylethylamino)propyl]furan-3-carboxamide
SMILESO=C(CCNC(=O)c1ccoc1)NCCc1cccs1
InChIInChI=1S/C14H16N2O3S/c17-13(15-6-3-12-2-1-9-20-12)4-7-16-14(18)11-5-8-19-10-11/h1-2,5,8-10H,3-4,6-7H2,(H,15,17)(H,16,18)
InChIKeyNJEPHMHEWHQNSW-UHFFFAOYSA-N
XLogP1.82
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.36
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-oxo-3-(2-thiophen-2-ylethylamino)propyl]naphthalene-2-carboxamide
CID 55569040
N-[3-(3-hydroxypropylamino)-3-oxopropyl]furan-3-carboxamide
CID 43427988
3-bromo-N-(2-thiophen-2-ylethyl)propanamide
CID 82109303
4-pyrrol-1-yl-N-(2-thiophen-2-ylethyl)benzamide
CID 27770345
4-hydroxy-N-(2-thiophen-2-ylethyl)butanamide
CID 13185709
N-[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]benzamide
CID 27770371
2-hydroxy-N-(2-thiophen-2-ylethyl)acetamide
CID 13454159
4-sulfanyl-N-(2-thiophen-2-ylethyl)benzamide
CID 107021162
3-pyrrol-1-yl-N-(2-thiophen-2-ylethyl)benzamide
CID 17453938
1-(furan-3-carbonyl)-N-(2-thiophen-2-ylethyl)piperidine-4-carboxamide
CID 134048432
3-chloro-N-(2-thiophen-2-ylethyl)benzamide
CID 18111212
4-oxo-4-(4-phenylphenyl)-N-(2-thiophen-2-ylethyl)butanamide
CID 17449159

Frequently Asked Questions

What is the IUPAC name of N-[3-oxo-3-(2-thiophen-2-ylethylamino)propyl]furan-3-carboxamide?
The IUPAC name of N-[3-oxo-3-(2-thiophen-2-ylethylamino)propyl]furan-3-carboxamide (CID 39931388) is N-[3-oxo-3-(2-thiophen-2-ylethylamino)propyl]furan-3-carboxamide.
What is the SMILES notation for N-[3-oxo-3-(2-thiophen-2-ylethylamino)propyl]furan-3-carboxamide?
The canonical SMILES for N-[3-oxo-3-(2-thiophen-2-ylethylamino)propyl]furan-3-carboxamide is O=C(CCNC(=O)c1ccoc1)NCCc1cccs1.
What is the InChIKey of N-[3-oxo-3-(2-thiophen-2-ylethylamino)propyl]furan-3-carboxamide?
The InChIKey is NJEPHMHEWHQNSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3S/c17-13(15-6-3-12-2-1-9-20-12)4-7-16-14(18)11-5-8-19-10-11/h1-2,5,8-10H,3-4,6-7H2,(H,15,17)(H,16,18).
What are the key properties of N-[3-oxo-3-(2-thiophen-2-ylethylamino)propyl]furan-3-carboxamide?
N-[3-oxo-3-(2-thiophen-2-ylethylamino)propyl]furan-3-carboxamide has a molecular weight of 292.36 g/mol, XLogP of 1.82, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-oxo-3-(2-thiophen-2-ylethylamino)propyl]furan-3-carboxamide is sourced from PubChem (CID 39931388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).