N-(2-amino-2-cyclopropylethyl)-2,5-dichlorothiophene-3-carboxamide

C10H12Cl2N2OS — CID 103872680

IUPACN-(2-amino-2-cyclopropylethyl)-2,5-dichlorothiophene-3-carboxamide
SMILESNC(CNC(=O)c1cc(Cl)sc1Cl)C1CC1
InChIInChI=1S/C10H12Cl2N2OS/c11-8-3-6(9(12)16-8)10(15)14-4-7(13)5-1-2-5/h3,5,7H,1-2,4,13H2,(H,14,15)
InChIKeyTWDLLXCXDKLCHN-UHFFFAOYSA-N
MW279.19 g/mol
LogP2.52
Rot. Bonds4

About N-(2-amino-2-cyclopropylethyl)-2,5-dichlorothiophene-3-carboxamide

N-(2-amino-2-cyclopropylethyl)-2,5-dichlorothiophene-3-carboxamide (PubChem CID 103872680) has the molecular formula C10H12Cl2N2OS and a molecular weight of 279.19 g/mol. Its IUPAC name is N-(2-amino-2-cyclopropylethyl)-2,5-dichlorothiophene-3-carboxamide.

Molecular Properties

Compound NameN-(2-amino-2-cyclopropylethyl)-2,5-dichlorothiophene-3-carboxamide
PubChem CID103872680
Molecular FormulaC10H12Cl2N2OS
Molecular Weight279.19 g/mol
Exact Mass278.00
IUPAC NameN-(2-amino-2-cyclopropylethyl)-2,5-dichlorothiophene-3-carboxamide
SMILESNC(CNC(=O)c1cc(Cl)sc1Cl)C1CC1
InChIInChI=1S/C10H12Cl2N2OS/c11-8-3-6(9(12)16-8)10(15)14-4-7(13)5-1-2-5/h3,5,7H,1-2,4,13H2,(H,14,15)
InChIKeyTWDLLXCXDKLCHN-UHFFFAOYSA-N
XLogP2.52
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.19
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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2,5-dichloro-N-(2,3-dihydroxypropyl)thiophene-3-carboxamide
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N-(4-bromo-2-methylbutyl)-2,5-dichlorothiophene-3-carboxamide
CID 107966173
N-(2-amino-2-cyclopropylethyl)-2-chloro-5-nitrobenzamide
CID 115301113
N-(2-amino-2-cyclopropylethyl)-2,6-dichlorobenzamide
CID 113282152
N-(2-amino-2-cyclopropylethyl)-2,4-dibromobenzamide
CID 107940139
N-(2-amino-2-cyclopropylethyl)-4,5-dimethylthiophene-2-carboxamide
CID 115301198
2,5-dichloro-N-(4-hydroxy-2-methylpentyl)thiophene-3-carboxamide
CID 111447072
N-(2-amino-2-cyclopropylethyl)-2-hydroxy-5-methylbenzamide
CID 55242936
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CID 103807484
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Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-cyclopropylethyl)-2,5-dichlorothiophene-3-carboxamide?
The IUPAC name of N-(2-amino-2-cyclopropylethyl)-2,5-dichlorothiophene-3-carboxamide (CID 103872680) is N-(2-amino-2-cyclopropylethyl)-2,5-dichlorothiophene-3-carboxamide.
What is the SMILES notation for N-(2-amino-2-cyclopropylethyl)-2,5-dichlorothiophene-3-carboxamide?
The canonical SMILES for N-(2-amino-2-cyclopropylethyl)-2,5-dichlorothiophene-3-carboxamide is NC(CNC(=O)c1cc(Cl)sc1Cl)C1CC1.
What is the InChIKey of N-(2-amino-2-cyclopropylethyl)-2,5-dichlorothiophene-3-carboxamide?
The InChIKey is TWDLLXCXDKLCHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12Cl2N2OS/c11-8-3-6(9(12)16-8)10(15)14-4-7(13)5-1-2-5/h3,5,7H,1-2,4,13H2,(H,14,15).
What are the key properties of N-(2-amino-2-cyclopropylethyl)-2,5-dichlorothiophene-3-carboxamide?
N-(2-amino-2-cyclopropylethyl)-2,5-dichlorothiophene-3-carboxamide has a molecular weight of 279.19 g/mol, XLogP of 2.52, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-cyclopropylethyl)-2,5-dichlorothiophene-3-carboxamide is sourced from PubChem (CID 103872680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).