(2S)-N-cyclopentyl-2-thiophen-2-ylpyrrolidine-1-carboxamide

C14H20N2OS — CID 38153751

IUPAC(2S)-N-cyclopentyl-2-thiophen-2-ylpyrrolidine-1-carboxamide
SMILESO=C(NC1CCCC1)N1CCC[C@H]1c1cccs1
InChIInChI=1S/C14H20N2OS/c17-14(15-11-5-1-2-6-11)16-9-3-7-12(16)13-8-4-10-18-13/h4,8,10-12H,1-3,5-7,9H2,(H,15,17)/t12-/m0/s1
InChIKeyBMENXZNKJLRGCC-LBPRGKRZSA-N
MW264.39 g/mol
LogP3.54
Rot. Bonds2

About (2S)-N-cyclopentyl-2-thiophen-2-ylpyrrolidine-1-carboxamide

(2S)-N-cyclopentyl-2-thiophen-2-ylpyrrolidine-1-carboxamide (PubChem CID 38153751) has the molecular formula C14H20N2OS and a molecular weight of 264.39 g/mol. Its IUPAC name is (2S)-N-cyclopentyl-2-thiophen-2-ylpyrrolidine-1-carboxamide.

Molecular Properties

Compound Name(2S)-N-cyclopentyl-2-thiophen-2-ylpyrrolidine-1-carboxamide
PubChem CID38153751
Molecular FormulaC14H20N2OS
Molecular Weight264.39 g/mol
Exact Mass264.13
IUPAC Name(2S)-N-cyclopentyl-2-thiophen-2-ylpyrrolidine-1-carboxamide
SMILESO=C(NC1CCCC1)N1CCC[C@H]1c1cccs1
InChIInChI=1S/C14H20N2OS/c17-14(15-11-5-1-2-6-11)16-9-3-7-12(16)13-8-4-10-18-13/h4,8,10-12H,1-3,5-7,9H2,(H,15,17)/t12-/m0/s1
InChIKeyBMENXZNKJLRGCC-LBPRGKRZSA-N
XLogP3.54
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.39
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2S)-N-cyclopentyl-2-thiophen-2-ylpyrrolidine-1-carboxamide?
The IUPAC name of (2S)-N-cyclopentyl-2-thiophen-2-ylpyrrolidine-1-carboxamide (CID 38153751) is (2S)-N-cyclopentyl-2-thiophen-2-ylpyrrolidine-1-carboxamide.
What is the SMILES notation for (2S)-N-cyclopentyl-2-thiophen-2-ylpyrrolidine-1-carboxamide?
The canonical SMILES for (2S)-N-cyclopentyl-2-thiophen-2-ylpyrrolidine-1-carboxamide is O=C(NC1CCCC1)N1CCC[C@H]1c1cccs1.
What is the InChIKey of (2S)-N-cyclopentyl-2-thiophen-2-ylpyrrolidine-1-carboxamide?
The InChIKey is BMENXZNKJLRGCC-LBPRGKRZSA-N. The full InChI is InChI=1S/C14H20N2OS/c17-14(15-11-5-1-2-6-11)16-9-3-7-12(16)13-8-4-10-18-13/h4,8,10-12H,1-3,5-7,9H2,(H,15,17)/t12-/m0/s1.
What are the key properties of (2S)-N-cyclopentyl-2-thiophen-2-ylpyrrolidine-1-carboxamide?
(2S)-N-cyclopentyl-2-thiophen-2-ylpyrrolidine-1-carboxamide has a molecular weight of 264.39 g/mol, XLogP of 3.54, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-cyclopentyl-2-thiophen-2-ylpyrrolidine-1-carboxamide is sourced from PubChem (CID 38153751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).