N-[2-oxo-2-[[2-oxo-2-[[2-oxo-2-(propylamino)ethyl]amino]ethyl]amino]ethyl]thiophene-2-carboxamide

C14H20N4O4S — CID 9163386

IUPACN-[2-oxo-2-[[2-oxo-2-[[2-oxo-2-(propylamino)ethyl]amino]ethyl]amino]ethyl]thiophene-2-carboxamide
SMILESCCCNC(=O)CNC(=O)CNC(=O)CNC(=O)c1cccs1
InChIInChI=1S/C14H20N4O4S/c1-2-5-15-11(19)7-16-12(20)8-17-13(21)9-18-14(22)10-4-3-6-23-10/h3-4,6H,2,5,7-9H2,1H3,(H,15,19)(H,16,20)(H,17,21)(H,18,22)
InChIKeyFASBDOJVFWIALG-UHFFFAOYSA-N
MW340.41 g/mol
LogP-0.76
Rot. Bonds9

About N-[2-oxo-2-[[2-oxo-2-[[2-oxo-2-(propylamino)ethyl]amino]ethyl]amino]ethyl]thiophene-2-carboxamide

N-[2-oxo-2-[[2-oxo-2-[[2-oxo-2-(propylamino)ethyl]amino]ethyl]amino]ethyl]thiophene-2-carboxamide (PubChem CID 9163386) has the molecular formula C14H20N4O4S and a molecular weight of 340.41 g/mol. Its IUPAC name is N-[2-oxo-2-[[2-oxo-2-[[2-oxo-2-(propylamino)ethyl]amino]ethyl]amino]ethyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[2-oxo-2-[[2-oxo-2-[[2-oxo-2-(propylamino)ethyl]amino]ethyl]amino]ethyl]thiophene-2-carboxamide
PubChem CID9163386
Molecular FormulaC14H20N4O4S
Molecular Weight340.41 g/mol
Exact Mass340.12
IUPAC NameN-[2-oxo-2-[[2-oxo-2-[[2-oxo-2-(propylamino)ethyl]amino]ethyl]amino]ethyl]thiophene-2-carboxamide
SMILESCCCNC(=O)CNC(=O)CNC(=O)CNC(=O)c1cccs1
InChIInChI=1S/C14H20N4O4S/c1-2-5-15-11(19)7-16-12(20)8-17-13(21)9-18-14(22)10-4-3-6-23-10/h3-4,6H,2,5,7-9H2,1H3,(H,15,19)(H,16,20)(H,17,21)(H,18,22)
InChIKeyFASBDOJVFWIALG-UHFFFAOYSA-N
XLogP-0.76
TPSA116.40 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.41
LogP ≤ 5-0.76
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Analyze N-[2-oxo-2-[[2-oxo-2-[[2-oxo-2-(propylamino)ethyl]amino]ethyl]amino]ethyl]thiophene-2-carboxamide with MolForge

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Related Compounds

(2S)-2-hydroxy-4-[[2-(thiophene-2-carbonylamino)acetyl]amino]butanoic acid
CID 107834928
1-propyl-3-(thiophene-2-carbonylamino)urea
CID 2727799
(2R)-2-[[2-(thiophene-2-carbonylamino)acetyl]amino]pentanoic acid
CID 107563695
N-[2-oxo-2-(2-phenylsulfanylethylamino)ethyl]thiophene-2-carboxamide
CID 26444525
N-[[4-oxo-4-(propylamino)butan-2-ylidene]amino]thiophene-2-carboxamide
CID 3108534
N-[2-[2-(4-methoxyphenyl)ethylamino]-2-oxoethyl]thiophene-2-carboxamide
CID 27548616
N-[2-[(3-hydroxy-3-phenylpropyl)amino]-2-oxoethyl]thiophene-2-carboxamide
CID 111471983
N-[2-[2-(1H-imidazol-2-yl)ethylamino]-2-oxoethyl]thiophene-2-carboxamide
CID 115668385
N-[2-[2-(2-methoxyphenyl)ethylamino]-2-oxoethyl]thiophene-2-carboxamide
CID 27757083
N-[2-[2-(1-adamantyl)ethylamino]-2-oxoethyl]thiophene-2-carboxamide
CID 35617769
(2S)-4-methyl-2-[[2-[[2-(thiophene-2-carbonylamino)acetyl]amino]acetyl]amino]pentanoic acid
CID 119361200
N-[2-[3-[benzyl(methyl)amino]propylamino]-2-oxoethyl]thiophene-2-carboxamide
CID 41306986

Frequently Asked Questions

What is the IUPAC name of N-[2-oxo-2-[[2-oxo-2-[[2-oxo-2-(propylamino)ethyl]amino]ethyl]amino]ethyl]thiophene-2-carboxamide?
The IUPAC name of N-[2-oxo-2-[[2-oxo-2-[[2-oxo-2-(propylamino)ethyl]amino]ethyl]amino]ethyl]thiophene-2-carboxamide (CID 9163386) is N-[2-oxo-2-[[2-oxo-2-[[2-oxo-2-(propylamino)ethyl]amino]ethyl]amino]ethyl]thiophene-2-carboxamide.
What is the SMILES notation for N-[2-oxo-2-[[2-oxo-2-[[2-oxo-2-(propylamino)ethyl]amino]ethyl]amino]ethyl]thiophene-2-carboxamide?
The canonical SMILES for N-[2-oxo-2-[[2-oxo-2-[[2-oxo-2-(propylamino)ethyl]amino]ethyl]amino]ethyl]thiophene-2-carboxamide is CCCNC(=O)CNC(=O)CNC(=O)CNC(=O)c1cccs1.
What is the InChIKey of N-[2-oxo-2-[[2-oxo-2-[[2-oxo-2-(propylamino)ethyl]amino]ethyl]amino]ethyl]thiophene-2-carboxamide?
The InChIKey is FASBDOJVFWIALG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O4S/c1-2-5-15-11(19)7-16-12(20)8-17-13(21)9-18-14(22)10-4-3-6-23-10/h3-4,6H,2,5,7-9H2,1H3,(H,15,19)(H,16,20)(H,17,21)(H,18,22).
What are the key properties of N-[2-oxo-2-[[2-oxo-2-[[2-oxo-2-(propylamino)ethyl]amino]ethyl]amino]ethyl]thiophene-2-carboxamide?
N-[2-oxo-2-[[2-oxo-2-[[2-oxo-2-(propylamino)ethyl]amino]ethyl]amino]ethyl]thiophene-2-carboxamide has a molecular weight of 340.41 g/mol, XLogP of -0.76, 9 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-oxo-2-[[2-oxo-2-[[2-oxo-2-(propylamino)ethyl]amino]ethyl]amino]ethyl]thiophene-2-carboxamide is sourced from PubChem (CID 9163386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).