N-[1-(hydroxymethyl)cyclopentyl]-1-methyl-5-oxopyrrolidine-3-carboxamide

C12H20N2O3 — CID 62519112

IUPACN-[1-(hydroxymethyl)cyclopentyl]-1-methyl-5-oxopyrrolidine-3-carboxamide
SMILESCN1CC(C(=O)NC2(CO)CCCC2)CC1=O
InChIInChI=1S/C12H20N2O3/c1-14-7-9(6-10(14)16)11(17)13-12(8-15)4-2-3-5-12/h9,15H,2-8H2,1H3,(H,13,17)
InChIKeyISRYEMWMPCFJRM-UHFFFAOYSA-N
MW240.30 g/mol
LogP-0.11
Rot. Bonds3

About N-[1-(hydroxymethyl)cyclopentyl]-1-methyl-5-oxopyrrolidine-3-carboxamide

N-[1-(hydroxymethyl)cyclopentyl]-1-methyl-5-oxopyrrolidine-3-carboxamide (PubChem CID 62519112) has the molecular formula C12H20N2O3 and a molecular weight of 240.30 g/mol. Its IUPAC name is N-[1-(hydroxymethyl)cyclopentyl]-1-methyl-5-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-[1-(hydroxymethyl)cyclopentyl]-1-methyl-5-oxopyrrolidine-3-carboxamide
PubChem CID62519112
Molecular FormulaC12H20N2O3
Molecular Weight240.30 g/mol
Exact Mass240.15
IUPAC NameN-[1-(hydroxymethyl)cyclopentyl]-1-methyl-5-oxopyrrolidine-3-carboxamide
SMILESCN1CC(C(=O)NC2(CO)CCCC2)CC1=O
InChIInChI=1S/C12H20N2O3/c1-14-7-9(6-10(14)16)11(17)13-12(8-15)4-2-3-5-12/h9,15H,2-8H2,1H3,(H,13,17)
InChIKeyISRYEMWMPCFJRM-UHFFFAOYSA-N
XLogP-0.11
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.30
LogP ≤ 5-0.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[1-(hydroxymethyl)cyclopentyl]-1-methyl-5-oxopyrrolidine-3-carboxamide?
The IUPAC name of N-[1-(hydroxymethyl)cyclopentyl]-1-methyl-5-oxopyrrolidine-3-carboxamide (CID 62519112) is N-[1-(hydroxymethyl)cyclopentyl]-1-methyl-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for N-[1-(hydroxymethyl)cyclopentyl]-1-methyl-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for N-[1-(hydroxymethyl)cyclopentyl]-1-methyl-5-oxopyrrolidine-3-carboxamide is CN1CC(C(=O)NC2(CO)CCCC2)CC1=O.
What is the InChIKey of N-[1-(hydroxymethyl)cyclopentyl]-1-methyl-5-oxopyrrolidine-3-carboxamide?
The InChIKey is ISRYEMWMPCFJRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O3/c1-14-7-9(6-10(14)16)11(17)13-12(8-15)4-2-3-5-12/h9,15H,2-8H2,1H3,(H,13,17).
What are the key properties of N-[1-(hydroxymethyl)cyclopentyl]-1-methyl-5-oxopyrrolidine-3-carboxamide?
N-[1-(hydroxymethyl)cyclopentyl]-1-methyl-5-oxopyrrolidine-3-carboxamide has a molecular weight of 240.30 g/mol, XLogP of -0.11, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(hydroxymethyl)cyclopentyl]-1-methyl-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 62519112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).