N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]-2-thiophen-2-ylacetamide

C15H18N2OS — CID 809988

IUPACN-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]-2-thiophen-2-ylacetamide
SMILESCn1cccc1CN(C(=O)Cc1cccs1)C1CC1
InChIInChI=1S/C15H18N2OS/c1-16-8-2-4-13(16)11-17(12-6-7-12)15(18)10-14-5-3-9-19-14/h2-5,8-9,12H,6-7,10-11H2,1H3
InChIKeyAJAPRTNZZMFFDT-UHFFFAOYSA-N
MW274.39 g/mol
LogP2.82
Rot. Bonds5

About N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]-2-thiophen-2-ylacetamide

N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]-2-thiophen-2-ylacetamide (PubChem CID 809988) has the molecular formula C15H18N2OS and a molecular weight of 274.39 g/mol. Its IUPAC name is N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]-2-thiophen-2-ylacetamide
PubChem CID809988
Molecular FormulaC15H18N2OS
Molecular Weight274.39 g/mol
Exact Mass274.11
IUPAC NameN-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]-2-thiophen-2-ylacetamide
SMILESCn1cccc1CN(C(=O)Cc1cccs1)C1CC1
InChIInChI=1S/C15H18N2OS/c1-16-8-2-4-13(16)11-17(12-6-7-12)15(18)10-14-5-3-9-19-14/h2-5,8-9,12H,6-7,10-11H2,1H3
InChIKeyAJAPRTNZZMFFDT-UHFFFAOYSA-N
XLogP2.82
TPSA25.24 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.39
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N'-((1-Methyl-1H-pyrrol-2-YL)methylene)-2-(2-thienyl)acetohydrazide
CID 6862500
2-(1-Methyl-1H-pyrrol-2-YL)-N'-(1-(2-thienyl)ethylidene)acetohydrazide
CID 5395305
N-Cyclohexyl-2-[cyclopropyl-(2-thiophen-2-yl-acetyl)-amino]-2-(1-methyl-1H-pyrrol-2-yl)-acetamide
CID 645756
2-(1-methyl-1H-pyrrol-2-yl)-N'-(2-thienylmethylene)acetohydrazide
CID 5641046
N-[[5-(hydroxycarbamoyl)thiophen-2-yl]methyl]-1-methylpyrrole-2-carboxamide
CID 73333212
2-(1-methyl-1H-pyrrol-2-yl)-N'-[(E)-(5-methyl-2-thienyl)methylidene]acetohydrazide
CID 6865177
2-(1H-pyrrol-1-yl)-N-(thien-2-ylmethyl)propanamide
CID 3239942
2-(1H-pyrrol-1-yl)-N-(thien-2-ylmethyl)acetamide
CID 3240250
N-cyclopropyl-3-(1H-pyrrol-1-yl)-2-thiophenecarboxamide
CID 4316567
N-[(E)-1-[2-(diethylamino)ethylcarbamoyl]-2-(1-methylpyrrol-2-yl)vinyl]thiophene-2-carboxamide
CID 5771244
Thiophene-2-carboxylic acid [1-(3-diethylamino-propylcarbamoyl)-2-(1-methyl-1H-pyrrol-2-yl)-vinyl]-amide
CID 5771246
N-[(E)-3-(3-methoxypropylamino)-1-(1-methylpyrrol-2-yl)-3-oxoprop-1-en-2-yl]thiophene-2-carboxamide
CID 5771248

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]-2-thiophen-2-ylacetamide?
The IUPAC name of N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]-2-thiophen-2-ylacetamide (CID 809988) is N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]-2-thiophen-2-ylacetamide?
The canonical SMILES for N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]-2-thiophen-2-ylacetamide is Cn1cccc1CN(C(=O)Cc1cccs1)C1CC1.
What is the InChIKey of N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]-2-thiophen-2-ylacetamide?
The InChIKey is AJAPRTNZZMFFDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2OS/c1-16-8-2-4-13(16)11-17(12-6-7-12)15(18)10-14-5-3-9-19-14/h2-5,8-9,12H,6-7,10-11H2,1H3.
What are the key properties of N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]-2-thiophen-2-ylacetamide?
N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]-2-thiophen-2-ylacetamide has a molecular weight of 274.39 g/mol, XLogP of 2.82, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]-2-thiophen-2-ylacetamide is sourced from PubChem (CID 809988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).