N-(2-amino-1-cyclopropylethyl)-4-methylthiophene-3-carboxamide;hydrochloride

C11H17ClN2OS — CID 119613848

IUPACN-(2-amino-1-cyclopropylethyl)-4-methylthiophene-3-carboxamide;hydrochloride
SMILESCc1cscc1C(=O)NC(CN)C1CC1.Cl
InChIInChI=1S/C11H16N2OS.ClH/c1-7-5-15-6-9(7)11(14)13-10(4-12)8-2-3-8;/h5-6,8,10H,2-4,12H2,1H3,(H,13,14);1H
InChIKeyFQBUJBXFWWAWOH-UHFFFAOYSA-N
MW260.79 g/mol
LogP1.95
Rot. Bonds4

About N-(2-amino-1-cyclopropylethyl)-4-methylthiophene-3-carboxamide;hydrochloride

N-(2-amino-1-cyclopropylethyl)-4-methylthiophene-3-carboxamide;hydrochloride (PubChem CID 119613848) has the molecular formula C11H17ClN2OS and a molecular weight of 260.79 g/mol. Its IUPAC name is N-(2-amino-1-cyclopropylethyl)-4-methylthiophene-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(2-amino-1-cyclopropylethyl)-4-methylthiophene-3-carboxamide;hydrochloride
PubChem CID119613848
Molecular FormulaC11H17ClN2OS
Molecular Weight260.79 g/mol
Exact Mass260.08
IUPAC NameN-(2-amino-1-cyclopropylethyl)-4-methylthiophene-3-carboxamide;hydrochloride
SMILESCc1cscc1C(=O)NC(CN)C1CC1.Cl
InChIInChI=1S/C11H16N2OS.ClH/c1-7-5-15-6-9(7)11(14)13-10(4-12)8-2-3-8;/h5-6,8,10H,2-4,12H2,1H3,(H,13,14);1H
InChIKeyFQBUJBXFWWAWOH-UHFFFAOYSA-N
XLogP1.95
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.79
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclopropylethyl)-4-methylthiophene-3-carboxamide;hydrochloride?
The IUPAC name of N-(2-amino-1-cyclopropylethyl)-4-methylthiophene-3-carboxamide;hydrochloride (CID 119613848) is N-(2-amino-1-cyclopropylethyl)-4-methylthiophene-3-carboxamide;hydrochloride.
What is the SMILES notation for N-(2-amino-1-cyclopropylethyl)-4-methylthiophene-3-carboxamide;hydrochloride?
The canonical SMILES for N-(2-amino-1-cyclopropylethyl)-4-methylthiophene-3-carboxamide;hydrochloride is Cc1cscc1C(=O)NC(CN)C1CC1.Cl.
What is the InChIKey of N-(2-amino-1-cyclopropylethyl)-4-methylthiophene-3-carboxamide;hydrochloride?
The InChIKey is FQBUJBXFWWAWOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2OS.ClH/c1-7-5-15-6-9(7)11(14)13-10(4-12)8-2-3-8;/h5-6,8,10H,2-4,12H2,1H3,(H,13,14);1H.
What are the key properties of N-(2-amino-1-cyclopropylethyl)-4-methylthiophene-3-carboxamide;hydrochloride?
N-(2-amino-1-cyclopropylethyl)-4-methylthiophene-3-carboxamide;hydrochloride has a molecular weight of 260.79 g/mol, XLogP of 1.95, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclopropylethyl)-4-methylthiophene-3-carboxamide;hydrochloride is sourced from PubChem (CID 119613848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).