N-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide

C12H18N2O2S — CID 2292963

IUPACN-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide
SMILESO=C(NCCCN1CCOCC1)c1cccs1
InChIInChI=1S/C12H18N2O2S/c15-12(11-3-1-10-17-11)13-4-2-5-14-6-8-16-9-7-14/h1,3,10H,2,4-9H2,(H,13,15)
InChIKeyHFIHWWHPGCTAEM-UHFFFAOYSA-N
MW254.35 g/mol
LogP1.20
Rot. Bonds5

About N-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide

N-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide (PubChem CID 2292963) has the molecular formula C12H18N2O2S and a molecular weight of 254.35 g/mol. Its IUPAC name is N-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide
PubChem CID2292963
Molecular FormulaC12H18N2O2S
Molecular Weight254.35 g/mol
Exact Mass254.11
IUPAC NameN-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide
SMILESO=C(NCCCN1CCOCC1)c1cccs1
InChIInChI=1S/C12H18N2O2S/c15-12(11-3-1-10-17-11)13-4-2-5-14-6-8-16-9-7-14/h1,3,10H,2,4-9H2,(H,13,15)
InChIKeyHFIHWWHPGCTAEM-UHFFFAOYSA-N
XLogP1.20
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.35
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide?
The IUPAC name of N-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide (CID 2292963) is N-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide.
What is the SMILES notation for N-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide?
The canonical SMILES for N-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide is O=C(NCCCN1CCOCC1)c1cccs1.
What is the InChIKey of N-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide?
The InChIKey is HFIHWWHPGCTAEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2S/c15-12(11-3-1-10-17-11)13-4-2-5-14-6-8-16-9-7-14/h1,3,10H,2,4-9H2,(H,13,15).
What are the key properties of N-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide?
N-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide has a molecular weight of 254.35 g/mol, XLogP of 1.20, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide is sourced from PubChem (CID 2292963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).