N-cyclopentyloxy-4-methoxypyrrolidine-2-carboxamide

C11H20N2O3 — CID 83235213

IUPACN-cyclopentyloxy-4-methoxypyrrolidine-2-carboxamide
SMILESCOC1CNC(C(=O)NOC2CCCC2)C1
InChIInChI=1S/C11H20N2O3/c1-15-9-6-10(12-7-9)11(14)13-16-8-4-2-3-5-8/h8-10,12H,2-7H2,1H3,(H,13,14)
InChIKeyBODRNVFECCNMDJ-UHFFFAOYSA-N
MW228.29 g/mol
LogP0.35
Rot. Bonds4

About N-cyclopentyloxy-4-methoxypyrrolidine-2-carboxamide

N-cyclopentyloxy-4-methoxypyrrolidine-2-carboxamide (PubChem CID 83235213) has the molecular formula C11H20N2O3 and a molecular weight of 228.29 g/mol. Its IUPAC name is N-cyclopentyloxy-4-methoxypyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopentyloxy-4-methoxypyrrolidine-2-carboxamide
PubChem CID83235213
Molecular FormulaC11H20N2O3
Molecular Weight228.29 g/mol
Exact Mass228.15
IUPAC NameN-cyclopentyloxy-4-methoxypyrrolidine-2-carboxamide
SMILESCOC1CNC(C(=O)NOC2CCCC2)C1
InChIInChI=1S/C11H20N2O3/c1-15-9-6-10(12-7-9)11(14)13-16-8-4-2-3-5-8/h8-10,12H,2-7H2,1H3,(H,13,14)
InChIKeyBODRNVFECCNMDJ-UHFFFAOYSA-N
XLogP0.35
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 50.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(2S,4S)-N,4-dimethoxypyrrolidine-2-carboxamide;hydrochloride
CID 130657923
4-methoxy-N-propan-2-ylpyrrolidine-2-carboxamide
CID 61213428
N-(2-cyclohexylethyl)-4-methoxypyrrolidine-2-carboxamide
CID 61215073
N-[(1S)-1-cyclopentylethyl]-4-methoxypyrrolidine-2-carboxamide
CID 81389076
methyl (2S,4S)-4-methoxypyrrolidine-2-carboxylate
CID 14036209
N-(2-ethylcyclohexyl)-4-methoxypyrrolidine-2-carboxamide
CID 61213322
N-(1-cyclopropylethyl)-4-methoxypyrrolidine-2-carboxamide
CID 61213308
4-methoxy-N-[(3-methylcyclohexyl)methyl]pyrrolidine-2-carboxamide
CID 103832995
(2R,4S)-4-methoxy-N-(2-methylcyclopropyl)pyrrolidine-2-carboxamide;hydrochloride
CID 130978968
1-(4-methoxypyrrolidin-2-yl)-2,2-dimethylpropan-1-one
CID 116560655
4-methoxypyrrolidine-2-carboxylic acid;hydrochloride
CID 77213691
4-methoxy-N-(1-methylsulfanylpropan-2-yl)pyrrolidine-2-carboxamide
CID 115753473

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyloxy-4-methoxypyrrolidine-2-carboxamide?
The IUPAC name of N-cyclopentyloxy-4-methoxypyrrolidine-2-carboxamide (CID 83235213) is N-cyclopentyloxy-4-methoxypyrrolidine-2-carboxamide.
What is the SMILES notation for N-cyclopentyloxy-4-methoxypyrrolidine-2-carboxamide?
The canonical SMILES for N-cyclopentyloxy-4-methoxypyrrolidine-2-carboxamide is COC1CNC(C(=O)NOC2CCCC2)C1.
What is the InChIKey of N-cyclopentyloxy-4-methoxypyrrolidine-2-carboxamide?
The InChIKey is BODRNVFECCNMDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3/c1-15-9-6-10(12-7-9)11(14)13-16-8-4-2-3-5-8/h8-10,12H,2-7H2,1H3,(H,13,14).
What are the key properties of N-cyclopentyloxy-4-methoxypyrrolidine-2-carboxamide?
N-cyclopentyloxy-4-methoxypyrrolidine-2-carboxamide has a molecular weight of 228.29 g/mol, XLogP of 0.35, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyloxy-4-methoxypyrrolidine-2-carboxamide is sourced from PubChem (CID 83235213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).