thiophen-3-amine;N-thiophen-3-ylpentanamide

C13H18N2OS2 — CID 158253806

IUPACthiophen-3-amine;N-thiophen-3-ylpentanamide
SMILESCCCCC(=O)Nc1ccsc1.Nc1ccsc1
InChIInChI=1S/C9H13NOS.C4H5NS/c1-2-3-4-9(11)10-8-5-6-12-7-8;5-4-1-2-6-3-4/h5-7H,2-4H2,1H3,(H,10,11);1-3H,5H2
InChIKeyGHAMCZNHPSHBNN-UHFFFAOYSA-N
MW282.43 g/mol
LogP4.21
Rot. Bonds4

About thiophen-3-amine;N-thiophen-3-ylpentanamide

thiophen-3-amine;N-thiophen-3-ylpentanamide (PubChem CID 158253806) has the molecular formula C13H18N2OS2 and a molecular weight of 282.43 g/mol. Its IUPAC name is thiophen-3-amine;N-thiophen-3-ylpentanamide.

Molecular Properties

Compound Namethiophen-3-amine;N-thiophen-3-ylpentanamide
PubChem CID158253806
Molecular FormulaC13H18N2OS2
Molecular Weight282.43 g/mol
Exact Mass282.09
IUPAC Namethiophen-3-amine;N-thiophen-3-ylpentanamide
SMILESCCCCC(=O)Nc1ccsc1.Nc1ccsc1
InChIInChI=1S/C9H13NOS.C4H5NS/c1-2-3-4-9(11)10-8-5-6-12-7-8;5-4-1-2-6-3-4/h5-7H,2-4H2,1H3,(H,10,11);1-3H,5H2
InChIKeyGHAMCZNHPSHBNN-UHFFFAOYSA-N
XLogP4.21
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 54.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-thiophen-3-ylbutanamide
CID 57133126
6-oxo-6-(thiophen-3-ylamino)hexanoic acid
CID 66350156
4-chloro-N-thiophen-3-ylbutanamide
CID 66352814
N-[4-(4-aminophenyl)phenyl]pentanamide
CID 90390735
butanoic acid;thiophen-3-amine;hydrochloride
CID 175171086
3-(tert-butylamino)-N-thiophen-3-ylpropanamide
CID 66351972
N-(4-methylphenyl)pentanamide
CID 3662375
N-[4-(methylamino)phenyl]pentanamide
CID 71040406
N-[4-(icosanoylamino)phenyl]icosanamide
CID 101291044
3-(3-aminophenoxy)-N-thiophen-3-ylpropanamide
CID 66351848
N-(4-aminophenyl)-4-pentylsulfanylbutanamide
CID 107748509
N-(5-chlorothiophen-3-yl)pentanamide
CID 130711050

Frequently Asked Questions

What is the IUPAC name of thiophen-3-amine;N-thiophen-3-ylpentanamide?
The IUPAC name of thiophen-3-amine;N-thiophen-3-ylpentanamide (CID 158253806) is thiophen-3-amine;N-thiophen-3-ylpentanamide.
What is the SMILES notation for thiophen-3-amine;N-thiophen-3-ylpentanamide?
The canonical SMILES for thiophen-3-amine;N-thiophen-3-ylpentanamide is CCCCC(=O)Nc1ccsc1.Nc1ccsc1.
What is the InChIKey of thiophen-3-amine;N-thiophen-3-ylpentanamide?
The InChIKey is GHAMCZNHPSHBNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NOS.C4H5NS/c1-2-3-4-9(11)10-8-5-6-12-7-8;5-4-1-2-6-3-4/h5-7H,2-4H2,1H3,(H,10,11);1-3H,5H2.
What are the key properties of thiophen-3-amine;N-thiophen-3-ylpentanamide?
thiophen-3-amine;N-thiophen-3-ylpentanamide has a molecular weight of 282.43 g/mol, XLogP of 4.21, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for thiophen-3-amine;N-thiophen-3-ylpentanamide is sourced from PubChem (CID 158253806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).