5-(cyclopropanecarbonylamino)-3-methyl-N-propyl-N-(2-thiophen-2-ylethyl)thiophene-2-carboxamide

C19H24N2O2S2 — CID 99821944

IUPAC5-(cyclopropanecarbonylamino)-3-methyl-N-propyl-N-(2-thiophen-2-ylethyl)thiophene-2-carboxamide
SMILESCCCN(CCc1cccs1)C(=O)c1sc(NC(=O)C2CC2)cc1C
InChIInChI=1S/C19H24N2O2S2/c1-3-9-21(10-8-15-5-4-11-24-15)19(23)17-13(2)12-16(25-17)20-18(22)14-6-7-14/h4-5,11-12,14H,3,6-10H2,1-2H3,(H,20,22)
InChIKeyRRXCXRHEYMCSOK-UHFFFAOYSA-N
MW376.55 g/mol
LogP4.56
Rot. Bonds8

About 5-(cyclopropanecarbonylamino)-3-methyl-N-propyl-N-(2-thiophen-2-ylethyl)thiophene-2-carboxamide

5-(cyclopropanecarbonylamino)-3-methyl-N-propyl-N-(2-thiophen-2-ylethyl)thiophene-2-carboxamide (PubChem CID 99821944) has the molecular formula C19H24N2O2S2 and a molecular weight of 376.55 g/mol. Its IUPAC name is 5-(cyclopropanecarbonylamino)-3-methyl-N-propyl-N-(2-thiophen-2-ylethyl)thiophene-2-carboxamide.

Molecular Properties

Compound Name5-(cyclopropanecarbonylamino)-3-methyl-N-propyl-N-(2-thiophen-2-ylethyl)thiophene-2-carboxamide
PubChem CID99821944
Molecular FormulaC19H24N2O2S2
Molecular Weight376.55 g/mol
Exact Mass376.13
IUPAC Name5-(cyclopropanecarbonylamino)-3-methyl-N-propyl-N-(2-thiophen-2-ylethyl)thiophene-2-carboxamide
SMILESCCCN(CCc1cccs1)C(=O)c1sc(NC(=O)C2CC2)cc1C
InChIInChI=1S/C19H24N2O2S2/c1-3-9-21(10-8-15-5-4-11-24-15)19(23)17-13(2)12-16(25-17)20-18(22)14-6-7-14/h4-5,11-12,14H,3,6-10H2,1-2H3,(H,20,22)
InChIKeyRRXCXRHEYMCSOK-UHFFFAOYSA-N
XLogP4.56
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.55
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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5-(cyclopropanecarbonylamino)-N-[2-(ethoxymethyl)phenyl]-3-methylthiophene-2-carboxamide
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Frequently Asked Questions

What is the IUPAC name of 5-(cyclopropanecarbonylamino)-3-methyl-N-propyl-N-(2-thiophen-2-ylethyl)thiophene-2-carboxamide?
The IUPAC name of 5-(cyclopropanecarbonylamino)-3-methyl-N-propyl-N-(2-thiophen-2-ylethyl)thiophene-2-carboxamide (CID 99821944) is 5-(cyclopropanecarbonylamino)-3-methyl-N-propyl-N-(2-thiophen-2-ylethyl)thiophene-2-carboxamide.
What is the SMILES notation for 5-(cyclopropanecarbonylamino)-3-methyl-N-propyl-N-(2-thiophen-2-ylethyl)thiophene-2-carboxamide?
The canonical SMILES for 5-(cyclopropanecarbonylamino)-3-methyl-N-propyl-N-(2-thiophen-2-ylethyl)thiophene-2-carboxamide is CCCN(CCc1cccs1)C(=O)c1sc(NC(=O)C2CC2)cc1C.
What is the InChIKey of 5-(cyclopropanecarbonylamino)-3-methyl-N-propyl-N-(2-thiophen-2-ylethyl)thiophene-2-carboxamide?
The InChIKey is RRXCXRHEYMCSOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2S2/c1-3-9-21(10-8-15-5-4-11-24-15)19(23)17-13(2)12-16(25-17)20-18(22)14-6-7-14/h4-5,11-12,14H,3,6-10H2,1-2H3,(H,20,22).
What are the key properties of 5-(cyclopropanecarbonylamino)-3-methyl-N-propyl-N-(2-thiophen-2-ylethyl)thiophene-2-carboxamide?
5-(cyclopropanecarbonylamino)-3-methyl-N-propyl-N-(2-thiophen-2-ylethyl)thiophene-2-carboxamide has a molecular weight of 376.55 g/mol, XLogP of 4.56, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclopropanecarbonylamino)-3-methyl-N-propyl-N-(2-thiophen-2-ylethyl)thiophene-2-carboxamide is sourced from PubChem (CID 99821944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).