N-[(3R)-3-(thiophene-2-carbonylamino)pentyl]thiophene-2-carboxamide

C15H18N2O2S2 — CID 40625219

IUPACN-[(3R)-3-(thiophene-2-carbonylamino)pentyl]thiophene-2-carboxamide
SMILESCC[C@H](CCNC(=O)c1cccs1)NC(=O)c1cccs1
InChIInChI=1S/C15H18N2O2S2/c1-2-11(17-15(19)13-6-4-10-21-13)7-8-16-14(18)12-5-3-9-20-12/h3-6,9-11H,2,7-8H2,1H3,(H,16,18)(H,17,19)/t11-/m1/s1
InChIKeyQENAEAMNLDZFKC-LLVKDONJSA-N
MW322.45 g/mol
LogP3.14
Rot. Bonds7

About N-[(3R)-3-(thiophene-2-carbonylamino)pentyl]thiophene-2-carboxamide

N-[(3R)-3-(thiophene-2-carbonylamino)pentyl]thiophene-2-carboxamide (PubChem CID 40625219) has the molecular formula C15H18N2O2S2 and a molecular weight of 322.45 g/mol. Its IUPAC name is N-[(3R)-3-(thiophene-2-carbonylamino)pentyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[(3R)-3-(thiophene-2-carbonylamino)pentyl]thiophene-2-carboxamide
PubChem CID40625219
Molecular FormulaC15H18N2O2S2
Molecular Weight322.45 g/mol
Exact Mass322.08
IUPAC NameN-[(3R)-3-(thiophene-2-carbonylamino)pentyl]thiophene-2-carboxamide
SMILESCC[C@H](CCNC(=O)c1cccs1)NC(=O)c1cccs1
InChIInChI=1S/C15H18N2O2S2/c1-2-11(17-15(19)13-6-4-10-21-13)7-8-16-14(18)12-5-3-9-20-12/h3-6,9-11H,2,7-8H2,1H3,(H,16,18)(H,17,19)/t11-/m1/s1
InChIKeyQENAEAMNLDZFKC-LLVKDONJSA-N
XLogP3.14
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.45
LogP ≤ 53.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(3R)-3-hydroxy-4,4-dimethylpentyl]thiophene-2-carboxamide
CID 95740854
N-(2-aminoethyl)thiophene-2-carboxamide
CID 4649097
N-(3-amino-3-phenylpropyl)thiophene-2-carboxamide
CID 80506792
N-[2-(ethylamino)ethyl]thiophene-2-carboxamide
CID 62657845
N-[2-[(2-amino-3-methylpentanoyl)amino]ethyl]thiophene-2-carboxamide;hydrochloride
CID 119727138
N-[4-(3-hydroxypentylamino)-4-oxobutyl]thiophene-2-carboxamide
CID 115703678
N-[(1S)-1-cyanopropyl]thiophene-2-carboxamide
CID 130638279
N-[2-(carbamoylamino)ethyl]thiophene-2-carboxamide
CID 115282462
N-(3-bromo-4-methoxybutyl)thiophene-2-carboxamide
CID 106245034
N-[2-[(2,2-dichloroacetyl)amino]ethyl]thiophene-2-carboxamide
CID 108573968
N-[2-(thiophene-2-carbonylamino)propyl]thiophene-2-carboxamide
CID 2837035
N-(3-amino-3-oxopropyl)thiophene-2-carboxamide
CID 43236649

Frequently Asked Questions

What is the IUPAC name of N-[(3R)-3-(thiophene-2-carbonylamino)pentyl]thiophene-2-carboxamide?
The IUPAC name of N-[(3R)-3-(thiophene-2-carbonylamino)pentyl]thiophene-2-carboxamide (CID 40625219) is N-[(3R)-3-(thiophene-2-carbonylamino)pentyl]thiophene-2-carboxamide.
What is the SMILES notation for N-[(3R)-3-(thiophene-2-carbonylamino)pentyl]thiophene-2-carboxamide?
The canonical SMILES for N-[(3R)-3-(thiophene-2-carbonylamino)pentyl]thiophene-2-carboxamide is CC[C@H](CCNC(=O)c1cccs1)NC(=O)c1cccs1.
What is the InChIKey of N-[(3R)-3-(thiophene-2-carbonylamino)pentyl]thiophene-2-carboxamide?
The InChIKey is QENAEAMNLDZFKC-LLVKDONJSA-N. The full InChI is InChI=1S/C15H18N2O2S2/c1-2-11(17-15(19)13-6-4-10-21-13)7-8-16-14(18)12-5-3-9-20-12/h3-6,9-11H,2,7-8H2,1H3,(H,16,18)(H,17,19)/t11-/m1/s1.
What are the key properties of N-[(3R)-3-(thiophene-2-carbonylamino)pentyl]thiophene-2-carboxamide?
N-[(3R)-3-(thiophene-2-carbonylamino)pentyl]thiophene-2-carboxamide has a molecular weight of 322.45 g/mol, XLogP of 3.14, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3R)-3-(thiophene-2-carbonylamino)pentyl]thiophene-2-carboxamide is sourced from PubChem (CID 40625219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).