N-(2-pyrrolidin-1-yl-2-thiophen-3-ylethyl)furan-2-carboxamide

C15H18N2O2S — CID 16931568

IUPACN-(2-pyrrolidin-1-yl-2-thiophen-3-ylethyl)furan-2-carboxamide
SMILESO=C(NCC(c1ccsc1)N1CCCC1)c1ccco1
InChIInChI=1S/C15H18N2O2S/c18-15(14-4-3-8-19-14)16-10-13(12-5-9-20-11-12)17-6-1-2-7-17/h3-5,8-9,11,13H,1-2,6-7,10H2,(H,16,18)
InChIKeyVGQXJJPYFQWYOB-UHFFFAOYSA-N
MW290.39 g/mol
LogP2.91
Rot. Bonds5

About N-(2-pyrrolidin-1-yl-2-thiophen-3-ylethyl)furan-2-carboxamide

N-(2-pyrrolidin-1-yl-2-thiophen-3-ylethyl)furan-2-carboxamide (PubChem CID 16931568) has the molecular formula C15H18N2O2S and a molecular weight of 290.39 g/mol. Its IUPAC name is N-(2-pyrrolidin-1-yl-2-thiophen-3-ylethyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(2-pyrrolidin-1-yl-2-thiophen-3-ylethyl)furan-2-carboxamide
PubChem CID16931568
Molecular FormulaC15H18N2O2S
Molecular Weight290.39 g/mol
Exact Mass290.11
IUPAC NameN-(2-pyrrolidin-1-yl-2-thiophen-3-ylethyl)furan-2-carboxamide
SMILESO=C(NCC(c1ccsc1)N1CCCC1)c1ccco1
InChIInChI=1S/C15H18N2O2S/c18-15(14-4-3-8-19-14)16-10-13(12-5-9-20-11-12)17-6-1-2-7-17/h3-5,8-9,11,13H,1-2,6-7,10H2,(H,16,18)
InChIKeyVGQXJJPYFQWYOB-UHFFFAOYSA-N
XLogP2.91
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.39
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2S)-2-pyrrolidin-1-yl-2-thiophen-3-ylethyl]thiophene-2-carboxamide
CID 40847538
N-[2-(azepan-1-yl)-2-thiophen-3-ylethyl]benzamide
CID 16931885
N-[2-(4-methoxyphenyl)-2-pyrrolidin-1-ylethyl]furan-2-carboxamide;hydrochloride
CID 52984979
N-(2-phenylethyl)-N'-[(2S)-2-pyrrolidin-1-yl-2-thiophen-3-ylethyl]oxamide
CID 40848792
N-[2-(2-chlorophenyl)-2-piperidin-1-ylethyl]furan-2-carboxamide
CID 17013059
N-[2-(azepan-1-yl)-2-thiophen-3-ylethyl]-4-chlorobenzamide
CID 16931789
N-[(2S)-2-(2-chlorophenyl)-2-piperidin-1-ylethyl]furan-2-carboxamide
CID 35043208
2-methyl-N-(2-pyrrolidin-1-yl-2-thiophen-3-ylethyl)propanamide
CID 16931597
2,6-dimethoxy-N-(2-piperidin-1-yl-2-thiophen-3-ylethyl)benzamide
CID 16931257
2-(4-chlorophenyl)-N-(2-piperidin-1-yl-2-thiophen-3-ylethyl)acetamide
CID 16931253
N-[(2R)-2-(furan-3-yl)-2-thiomorpholin-4-ylethyl]furan-2-carboxamide
CID 124760075
N'-[(2S)-2-pyrrolidin-1-yl-2-thiophen-3-ylethyl]-N-(thiophen-2-ylmethyl)oxamide
CID 40848684

Frequently Asked Questions

What is the IUPAC name of N-(2-pyrrolidin-1-yl-2-thiophen-3-ylethyl)furan-2-carboxamide?
The IUPAC name of N-(2-pyrrolidin-1-yl-2-thiophen-3-ylethyl)furan-2-carboxamide (CID 16931568) is N-(2-pyrrolidin-1-yl-2-thiophen-3-ylethyl)furan-2-carboxamide.
What is the SMILES notation for N-(2-pyrrolidin-1-yl-2-thiophen-3-ylethyl)furan-2-carboxamide?
The canonical SMILES for N-(2-pyrrolidin-1-yl-2-thiophen-3-ylethyl)furan-2-carboxamide is O=C(NCC(c1ccsc1)N1CCCC1)c1ccco1.
What is the InChIKey of N-(2-pyrrolidin-1-yl-2-thiophen-3-ylethyl)furan-2-carboxamide?
The InChIKey is VGQXJJPYFQWYOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2S/c18-15(14-4-3-8-19-14)16-10-13(12-5-9-20-11-12)17-6-1-2-7-17/h3-5,8-9,11,13H,1-2,6-7,10H2,(H,16,18).
What are the key properties of N-(2-pyrrolidin-1-yl-2-thiophen-3-ylethyl)furan-2-carboxamide?
N-(2-pyrrolidin-1-yl-2-thiophen-3-ylethyl)furan-2-carboxamide has a molecular weight of 290.39 g/mol, XLogP of 2.91, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-pyrrolidin-1-yl-2-thiophen-3-ylethyl)furan-2-carboxamide is sourced from PubChem (CID 16931568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).