1-phenyl-N-(thiophen-2-ylmethyl)cyclopropane-1-carboxamide

C15H15NOS — CID 2517264

IUPAC1-phenyl-N-(thiophen-2-ylmethyl)cyclopropane-1-carboxamide
SMILESO=C(NCc1cccs1)C1(c2ccccc2)CC1
InChIInChI=1S/C15H15NOS/c17-14(16-11-13-7-4-10-18-13)15(8-9-15)12-5-2-1-3-6-12/h1-7,10H,8-9,11H2,(H,16,17)
InChIKeyIFFYSAUVXLIKER-UHFFFAOYSA-N
MW257.36 g/mol
LogP3.10
Rot. Bonds4

About 1-phenyl-N-(thiophen-2-ylmethyl)cyclopropane-1-carboxamide

1-phenyl-N-(thiophen-2-ylmethyl)cyclopropane-1-carboxamide (PubChem CID 2517264) has the molecular formula C15H15NOS and a molecular weight of 257.36 g/mol. Its IUPAC name is 1-phenyl-N-(thiophen-2-ylmethyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-phenyl-N-(thiophen-2-ylmethyl)cyclopropane-1-carboxamide
PubChem CID2517264
Molecular FormulaC15H15NOS
Molecular Weight257.36 g/mol
Exact Mass257.09
IUPAC Name1-phenyl-N-(thiophen-2-ylmethyl)cyclopropane-1-carboxamide
SMILESO=C(NCc1cccs1)C1(c2ccccc2)CC1
InChIInChI=1S/C15H15NOS/c17-14(16-11-13-7-4-10-18-13)15(8-9-15)12-5-2-1-3-6-12/h1-7,10H,8-9,11H2,(H,16,17)
InChIKeyIFFYSAUVXLIKER-UHFFFAOYSA-N
XLogP3.10
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.36
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(thiophen-2-ylmethylcarbamoyl)cyclobutane-1-carboxylic acid
CID 62096590
1-(hydroxymethyl)-N-(thiophen-2-ylmethyl)cyclobutane-1-carboxamide
CID 115184040
1-[4-(2-methylpropanoylamino)phenyl]-N-(thiophen-2-ylmethyl)cyclohexane-1-carboxamide
CID 53110454
1-phenyl-N-(pyridin-2-ylmethyl)cyclopropane-1-carboxamide
CID 30944923
3-(thiophen-2-ylmethylcarbamoyl)oxetane-3-carboxylic acid
CID 115184971
N-[(4-fluorophenyl)methyl]-1-phenylcyclopropane-1-carboxamide
CID 2540117
4-phenyl-N-[(2-thiophen-2-yl-3-pyridinyl)methyl]oxane-4-carboxamide
CID 91625766
3-phenyl-N-(thiophen-2-ylmethyl)adamantane-1-carboxamide
CID 52990919
N-(thiophen-2-ylmethyl)adamantane-1-carboxamide
CID 2805256
N,N'-bis(thiophen-2-ylmethyl)oxamide
CID 6421749
1-ethyl-2-phenyl-N-(thiophen-2-ylmethyl)cyclopropane-1-carboxamide
CID 174883213
1-(4-chlorophenyl)-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]cyclopropane-1-carboxamide
CID 24548909

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-N-(thiophen-2-ylmethyl)cyclopropane-1-carboxamide?
The IUPAC name of 1-phenyl-N-(thiophen-2-ylmethyl)cyclopropane-1-carboxamide (CID 2517264) is 1-phenyl-N-(thiophen-2-ylmethyl)cyclopropane-1-carboxamide.
What is the SMILES notation for 1-phenyl-N-(thiophen-2-ylmethyl)cyclopropane-1-carboxamide?
The canonical SMILES for 1-phenyl-N-(thiophen-2-ylmethyl)cyclopropane-1-carboxamide is O=C(NCc1cccs1)C1(c2ccccc2)CC1.
What is the InChIKey of 1-phenyl-N-(thiophen-2-ylmethyl)cyclopropane-1-carboxamide?
The InChIKey is IFFYSAUVXLIKER-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NOS/c17-14(16-11-13-7-4-10-18-13)15(8-9-15)12-5-2-1-3-6-12/h1-7,10H,8-9,11H2,(H,16,17).
What are the key properties of 1-phenyl-N-(thiophen-2-ylmethyl)cyclopropane-1-carboxamide?
1-phenyl-N-(thiophen-2-ylmethyl)cyclopropane-1-carboxamide has a molecular weight of 257.36 g/mol, XLogP of 3.10, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-N-(thiophen-2-ylmethyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 2517264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).