N-[3-[methoxy(methyl)amino]-3-oxopropyl]thiophene-3-carboxamide

C10H14N2O3S — CID 60656257

IUPACN-[3-[methoxy(methyl)amino]-3-oxopropyl]thiophene-3-carboxamide
SMILESCON(C)C(=O)CCNC(=O)c1ccsc1
InChIInChI=1S/C10H14N2O3S/c1-12(15-2)9(13)3-5-11-10(14)8-4-6-16-7-8/h4,6-7H,3,5H2,1-2H3,(H,11,14)
InChIKeyXFPJZLUZLOVXJS-UHFFFAOYSA-N
MW242.30 g/mol
LogP0.89
Rot. Bonds5

About N-[3-[methoxy(methyl)amino]-3-oxopropyl]thiophene-3-carboxamide

N-[3-[methoxy(methyl)amino]-3-oxopropyl]thiophene-3-carboxamide (PubChem CID 60656257) has the molecular formula C10H14N2O3S and a molecular weight of 242.30 g/mol. Its IUPAC name is N-[3-[methoxy(methyl)amino]-3-oxopropyl]thiophene-3-carboxamide.

Molecular Properties

Compound NameN-[3-[methoxy(methyl)amino]-3-oxopropyl]thiophene-3-carboxamide
PubChem CID60656257
Molecular FormulaC10H14N2O3S
Molecular Weight242.30 g/mol
Exact Mass242.07
IUPAC NameN-[3-[methoxy(methyl)amino]-3-oxopropyl]thiophene-3-carboxamide
SMILESCON(C)C(=O)CCNC(=O)c1ccsc1
InChIInChI=1S/C10H14N2O3S/c1-12(15-2)9(13)3-5-11-10(14)8-4-6-16-7-8/h4,6-7H,3,5H2,1-2H3,(H,11,14)
InChIKeyXFPJZLUZLOVXJS-UHFFFAOYSA-N
XLogP0.89
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.30
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[3-[butan-2-yl(methyl)amino]-3-oxopropyl]thiophene-3-carboxamide
CID 134006121
N-[3-[2-hydroxyethyl(2-methoxyethyl)amino]-3-oxopropyl]thiophene-3-carboxamide
CID 115772753
2-[carboxymethyl-[3-(thiophene-3-carbonylamino)propanoyl]amino]acetic acid
CID 63645564
4-chloro-N-[3-[methoxy(methyl)amino]-3-oxopropyl]benzamide
CID 18283094
methyl 2-[propyl-[3-(thiophene-3-carbonylamino)propanoyl]amino]acetate
CID 61224315
N-[2-(thiophene-3-carbonylamino)ethyl]thiophene-3-carboxamide
CID 101004058
2-methoxyethyl 3-(thiophene-3-carbonylamino)propanoate
CID 86913899
N-[3-[bis(prop-2-enyl)amino]-3-oxopropyl]thiophene-3-carboxamide
CID 78803647
N-[3-[[4-(dimethylamino)phenyl]methyl-methylamino]-3-oxopropyl]thiophene-3-carboxamide
CID 78803022
N-[3-[[(1S)-1-(3,4-difluorophenyl)ethyl]-methylamino]-3-oxopropyl]thiophene-3-carboxamide
CID 31160526
N-[3-(3-methylbutan-2-ylamino)-3-oxopropyl]thiophene-3-carboxamide
CID 43043343
N-[3-[(3-fluorophenyl)methyl-methylamino]-3-oxopropyl]thiophene-3-carboxamide
CID 18113918

Frequently Asked Questions

What is the IUPAC name of N-[3-[methoxy(methyl)amino]-3-oxopropyl]thiophene-3-carboxamide?
The IUPAC name of N-[3-[methoxy(methyl)amino]-3-oxopropyl]thiophene-3-carboxamide (CID 60656257) is N-[3-[methoxy(methyl)amino]-3-oxopropyl]thiophene-3-carboxamide.
What is the SMILES notation for N-[3-[methoxy(methyl)amino]-3-oxopropyl]thiophene-3-carboxamide?
The canonical SMILES for N-[3-[methoxy(methyl)amino]-3-oxopropyl]thiophene-3-carboxamide is CON(C)C(=O)CCNC(=O)c1ccsc1.
What is the InChIKey of N-[3-[methoxy(methyl)amino]-3-oxopropyl]thiophene-3-carboxamide?
The InChIKey is XFPJZLUZLOVXJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O3S/c1-12(15-2)9(13)3-5-11-10(14)8-4-6-16-7-8/h4,6-7H,3,5H2,1-2H3,(H,11,14).
What are the key properties of N-[3-[methoxy(methyl)amino]-3-oxopropyl]thiophene-3-carboxamide?
N-[3-[methoxy(methyl)amino]-3-oxopropyl]thiophene-3-carboxamide has a molecular weight of 242.30 g/mol, XLogP of 0.89, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[methoxy(methyl)amino]-3-oxopropyl]thiophene-3-carboxamide is sourced from PubChem (CID 60656257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).