N-cyclopentyl-2-pyrrol-1-ylpropanamide

C12H18N2O — CID 23603041

IUPACN-cyclopentyl-2-pyrrol-1-ylpropanamide
SMILESCC(C(=O)NC1CCCC1)n1cccc1
InChIInChI=1S/C12H18N2O/c1-10(14-8-4-5-9-14)12(15)13-11-6-2-3-7-11/h4-5,8-11H,2-3,6-7H2,1H3,(H,13,15)
InChIKeyHYSZKMLJYYJWAL-UHFFFAOYSA-N
MW206.29 g/mol
LogP2.11
Rot. Bonds3

About N-cyclopentyl-2-pyrrol-1-ylpropanamide

N-cyclopentyl-2-pyrrol-1-ylpropanamide (PubChem CID 23603041) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is N-cyclopentyl-2-pyrrol-1-ylpropanamide.

Molecular Properties

Compound NameN-cyclopentyl-2-pyrrol-1-ylpropanamide
PubChem CID23603041
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC NameN-cyclopentyl-2-pyrrol-1-ylpropanamide
SMILESCC(C(=O)NC1CCCC1)n1cccc1
InChIInChI=1S/C12H18N2O/c1-10(14-8-4-5-9-14)12(15)13-11-6-2-3-7-11/h4-5,8-11H,2-3,6-7H2,1H3,(H,13,15)
InChIKeyHYSZKMLJYYJWAL-UHFFFAOYSA-N
XLogP2.11
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-pyrrol-1-ylpropanamide?
The IUPAC name of N-cyclopentyl-2-pyrrol-1-ylpropanamide (CID 23603041) is N-cyclopentyl-2-pyrrol-1-ylpropanamide.
What is the SMILES notation for N-cyclopentyl-2-pyrrol-1-ylpropanamide?
The canonical SMILES for N-cyclopentyl-2-pyrrol-1-ylpropanamide is CC(C(=O)NC1CCCC1)n1cccc1.
What is the InChIKey of N-cyclopentyl-2-pyrrol-1-ylpropanamide?
The InChIKey is HYSZKMLJYYJWAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c1-10(14-8-4-5-9-14)12(15)13-11-6-2-3-7-11/h4-5,8-11H,2-3,6-7H2,1H3,(H,13,15).
What are the key properties of N-cyclopentyl-2-pyrrol-1-ylpropanamide?
N-cyclopentyl-2-pyrrol-1-ylpropanamide has a molecular weight of 206.29 g/mol, XLogP of 2.11, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-pyrrol-1-ylpropanamide is sourced from PubChem (CID 23603041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).