5-(cyclopropanecarbonylamino)-3-methyl-N-(4-methylcyclohexyl)thiophene-2-carboxamide

C17H24N2O2S — CID 24608405

IUPAC5-(cyclopropanecarbonylamino)-3-methyl-N-(4-methylcyclohexyl)thiophene-2-carboxamide
SMILESCc1cc(NC(=O)C2CC2)sc1C(=O)NC1CCC(C)CC1
InChIInChI=1S/C17H24N2O2S/c1-10-3-7-13(8-4-10)18-17(21)15-11(2)9-14(22-15)19-16(20)12-5-6-12/h9-10,12-13H,3-8H2,1-2H3,(H,18,21)(H,19,20)
InChIKeyFQKWNHNDVDIDGO-UHFFFAOYSA-N
MW320.46 g/mol
LogP3.71
Rot. Bonds4

About 5-(cyclopropanecarbonylamino)-3-methyl-N-(4-methylcyclohexyl)thiophene-2-carboxamide

5-(cyclopropanecarbonylamino)-3-methyl-N-(4-methylcyclohexyl)thiophene-2-carboxamide (PubChem CID 24608405) has the molecular formula C17H24N2O2S and a molecular weight of 320.46 g/mol. Its IUPAC name is 5-(cyclopropanecarbonylamino)-3-methyl-N-(4-methylcyclohexyl)thiophene-2-carboxamide.

Molecular Properties

Compound Name5-(cyclopropanecarbonylamino)-3-methyl-N-(4-methylcyclohexyl)thiophene-2-carboxamide
PubChem CID24608405
Molecular FormulaC17H24N2O2S
Molecular Weight320.46 g/mol
Exact Mass320.16
IUPAC Name5-(cyclopropanecarbonylamino)-3-methyl-N-(4-methylcyclohexyl)thiophene-2-carboxamide
SMILESCc1cc(NC(=O)C2CC2)sc1C(=O)NC1CCC(C)CC1
InChIInChI=1S/C17H24N2O2S/c1-10-3-7-13(8-4-10)18-17(21)15-11(2)9-14(22-15)19-16(20)12-5-6-12/h9-10,12-13H,3-8H2,1-2H3,(H,18,21)(H,19,20)
InChIKeyFQKWNHNDVDIDGO-UHFFFAOYSA-N
XLogP3.71
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.46
LogP ≤ 53.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(cyclopropanecarbonylamino)-3-methyl-N-(4-methylcyclohexyl)thiophene-2-carboxamide?
The IUPAC name of 5-(cyclopropanecarbonylamino)-3-methyl-N-(4-methylcyclohexyl)thiophene-2-carboxamide (CID 24608405) is 5-(cyclopropanecarbonylamino)-3-methyl-N-(4-methylcyclohexyl)thiophene-2-carboxamide.
What is the SMILES notation for 5-(cyclopropanecarbonylamino)-3-methyl-N-(4-methylcyclohexyl)thiophene-2-carboxamide?
The canonical SMILES for 5-(cyclopropanecarbonylamino)-3-methyl-N-(4-methylcyclohexyl)thiophene-2-carboxamide is Cc1cc(NC(=O)C2CC2)sc1C(=O)NC1CCC(C)CC1.
What is the InChIKey of 5-(cyclopropanecarbonylamino)-3-methyl-N-(4-methylcyclohexyl)thiophene-2-carboxamide?
The InChIKey is FQKWNHNDVDIDGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2S/c1-10-3-7-13(8-4-10)18-17(21)15-11(2)9-14(22-15)19-16(20)12-5-6-12/h9-10,12-13H,3-8H2,1-2H3,(H,18,21)(H,19,20).
What are the key properties of 5-(cyclopropanecarbonylamino)-3-methyl-N-(4-methylcyclohexyl)thiophene-2-carboxamide?
5-(cyclopropanecarbonylamino)-3-methyl-N-(4-methylcyclohexyl)thiophene-2-carboxamide has a molecular weight of 320.46 g/mol, XLogP of 3.71, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclopropanecarbonylamino)-3-methyl-N-(4-methylcyclohexyl)thiophene-2-carboxamide is sourced from PubChem (CID 24608405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).