N-[2-(diethylamino)propyl]-4,5-dimethylthiophene-2-carboxamide

C14H24N2OS — CID 86982985

IUPACN-[2-(diethylamino)propyl]-4,5-dimethylthiophene-2-carboxamide
SMILESCCN(CC)C(C)CNC(=O)c1cc(C)c(C)s1
InChIInChI=1S/C14H24N2OS/c1-6-16(7-2)11(4)9-15-14(17)13-8-10(3)12(5)18-13/h8,11H,6-7,9H2,1-5H3,(H,15,17)
InChIKeyYPAPWAQIDAXXPU-UHFFFAOYSA-N
MW268.43 g/mol
LogP2.83
Rot. Bonds6

About N-[2-(diethylamino)propyl]-4,5-dimethylthiophene-2-carboxamide

N-[2-(diethylamino)propyl]-4,5-dimethylthiophene-2-carboxamide (PubChem CID 86982985) has the molecular formula C14H24N2OS and a molecular weight of 268.43 g/mol. Its IUPAC name is N-[2-(diethylamino)propyl]-4,5-dimethylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-[2-(diethylamino)propyl]-4,5-dimethylthiophene-2-carboxamide
PubChem CID86982985
Molecular FormulaC14H24N2OS
Molecular Weight268.43 g/mol
Exact Mass268.16
IUPAC NameN-[2-(diethylamino)propyl]-4,5-dimethylthiophene-2-carboxamide
SMILESCCN(CC)C(C)CNC(=O)c1cc(C)c(C)s1
InChIInChI=1S/C14H24N2OS/c1-6-16(7-2)11(4)9-15-14(17)13-8-10(3)12(5)18-13/h8,11H,6-7,9H2,1-5H3,(H,15,17)
InChIKeyYPAPWAQIDAXXPU-UHFFFAOYSA-N
XLogP2.83
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.43
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-chloropropyl)-4,5-dimethylthiophene-2-carboxamide
CID 114296674
N-[(2R)-2-hydroxypropyl]-4,5-dimethylthiophene-2-carboxamide
CID 83031116
N-(2,2-diethoxyethyl)-4,5-dimethylthiophene-2-carboxamide
CID 78909936
N-(2,2-dimethoxyethyl)-4,5-dimethylthiophene-2-carboxamide
CID 60655347
N-(2,3-dihydroxypropyl)-4,5-dimethylthiophene-2-carboxamide
CID 66175829
4,5-dimethyl-N-(2-morpholin-4-ylpropyl)thiophene-2-carboxamide
CID 47168421
N-(3-aminobutyl)-4,5-dimethylthiophene-2-carboxamide
CID 65239032
N-(2-amino-2-cyclopropylethyl)-4,5-dimethylthiophene-2-carboxamide
CID 115301198
N-(2-cyclopentyl-2-hydroxyethyl)-4,5-dimethylthiophene-2-carboxamide
CID 111426339
N-(2-acetamidoethyl)-4,5-dimethylthiophene-2-carboxamide
CID 30596154
N-(3-hydroxypropyl)-4,5-dimethylthiophene-2-carboxamide
CID 43391417
N-(2-hydroxy-2-methylbutyl)-4,5-dimethylthiophene-2-carboxamide
CID 65112566

Frequently Asked Questions

What is the IUPAC name of N-[2-(diethylamino)propyl]-4,5-dimethylthiophene-2-carboxamide?
The IUPAC name of N-[2-(diethylamino)propyl]-4,5-dimethylthiophene-2-carboxamide (CID 86982985) is N-[2-(diethylamino)propyl]-4,5-dimethylthiophene-2-carboxamide.
What is the SMILES notation for N-[2-(diethylamino)propyl]-4,5-dimethylthiophene-2-carboxamide?
The canonical SMILES for N-[2-(diethylamino)propyl]-4,5-dimethylthiophene-2-carboxamide is CCN(CC)C(C)CNC(=O)c1cc(C)c(C)s1.
What is the InChIKey of N-[2-(diethylamino)propyl]-4,5-dimethylthiophene-2-carboxamide?
The InChIKey is YPAPWAQIDAXXPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2OS/c1-6-16(7-2)11(4)9-15-14(17)13-8-10(3)12(5)18-13/h8,11H,6-7,9H2,1-5H3,(H,15,17).
What are the key properties of N-[2-(diethylamino)propyl]-4,5-dimethylthiophene-2-carboxamide?
N-[2-(diethylamino)propyl]-4,5-dimethylthiophene-2-carboxamide has a molecular weight of 268.43 g/mol, XLogP of 2.83, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(diethylamino)propyl]-4,5-dimethylthiophene-2-carboxamide is sourced from PubChem (CID 86982985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).