N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-5-methylthiophene-2-carboxamide

C14H18N2OS2 — CID 32630977

IUPACN-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-5-methylthiophene-2-carboxamide
SMILESCc1ccc(C(=O)NC[C@@H](c2ccsc2)N(C)C)s1
InChIInChI=1S/C14H18N2OS2/c1-10-4-5-13(19-10)14(17)15-8-12(16(2)3)11-6-7-18-9-11/h4-7,9,12H,8H2,1-3H3,(H,15,17)/t12-/m0/s1
InChIKeyVOGFTDISLBDLOU-LBPRGKRZSA-N
MW294.45 g/mol
LogP3.15
Rot. Bonds5

About N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-5-methylthiophene-2-carboxamide

N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-5-methylthiophene-2-carboxamide (PubChem CID 32630977) has the molecular formula C14H18N2OS2 and a molecular weight of 294.45 g/mol. Its IUPAC name is N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-5-methylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-5-methylthiophene-2-carboxamide
PubChem CID32630977
Molecular FormulaC14H18N2OS2
Molecular Weight294.45 g/mol
Exact Mass294.09
IUPAC NameN-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-5-methylthiophene-2-carboxamide
SMILESCc1ccc(C(=O)NC[C@@H](c2ccsc2)N(C)C)s1
InChIInChI=1S/C14H18N2OS2/c1-10-4-5-13(19-10)14(17)15-8-12(16(2)3)11-6-7-18-9-11/h4-7,9,12H,8H2,1-3H3,(H,15,17)/t12-/m0/s1
InChIKeyVOGFTDISLBDLOU-LBPRGKRZSA-N
XLogP3.15
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.45
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-5-methylthiophene-2-carboxamide?
The IUPAC name of N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-5-methylthiophene-2-carboxamide (CID 32630977) is N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-5-methylthiophene-2-carboxamide.
What is the SMILES notation for N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-5-methylthiophene-2-carboxamide?
The canonical SMILES for N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-5-methylthiophene-2-carboxamide is Cc1ccc(C(=O)NC[C@@H](c2ccsc2)N(C)C)s1.
What is the InChIKey of N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-5-methylthiophene-2-carboxamide?
The InChIKey is VOGFTDISLBDLOU-LBPRGKRZSA-N. The full InChI is InChI=1S/C14H18N2OS2/c1-10-4-5-13(19-10)14(17)15-8-12(16(2)3)11-6-7-18-9-11/h4-7,9,12H,8H2,1-3H3,(H,15,17)/t12-/m0/s1.
What are the key properties of N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-5-methylthiophene-2-carboxamide?
N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-5-methylthiophene-2-carboxamide has a molecular weight of 294.45 g/mol, XLogP of 3.15, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-5-methylthiophene-2-carboxamide is sourced from PubChem (CID 32630977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).