N'-cyclopentyl-3-methoxypyrrolidine-1-carboximidamide

C11H21N3O — CID 103534597

IUPACN'-cyclopentyl-3-methoxypyrrolidine-1-carboximidamide
SMILESCOC1CCN(/C(N)=N/C2CCCC2)C1
InChIInChI=1S/C11H21N3O/c1-15-10-6-7-14(8-10)11(12)13-9-4-2-3-5-9/h9-10H,2-8H2,1H3,(H2,12,13)
InChIKeyFZQBDFUXLJAXAS-UHFFFAOYSA-N
MW211.31 g/mol
LogP0.96
Rot. Bonds2

About N'-cyclopentyl-3-methoxypyrrolidine-1-carboximidamide

N'-cyclopentyl-3-methoxypyrrolidine-1-carboximidamide (PubChem CID 103534597) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is N'-cyclopentyl-3-methoxypyrrolidine-1-carboximidamide.

Molecular Properties

Compound NameN'-cyclopentyl-3-methoxypyrrolidine-1-carboximidamide
PubChem CID103534597
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC NameN'-cyclopentyl-3-methoxypyrrolidine-1-carboximidamide
SMILESCOC1CCN(/C(N)=N/C2CCCC2)C1
InChIInChI=1S/C11H21N3O/c1-15-10-6-7-14(8-10)11(12)13-9-4-2-3-5-9/h9-10H,2-8H2,1H3,(H2,12,13)
InChIKeyFZQBDFUXLJAXAS-UHFFFAOYSA-N
XLogP0.96
TPSA50.85 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

2-Cyclopentyl-1-(2-methoxyethyl)-1-(2-methylpropyl)guanidine
CID 55063915
2-Cyclopentyl-1,1-bis(2-methoxyethyl)guanidine
CID 62361629
2-Cyclopentyl-1-methyl-1-(oxolan-2-ylmethyl)guanidine
CID 62361631
2-Cyclopentyl-1-ethyl-1-(1-methoxypropan-2-yl)guanidine
CID 62361643
2-Cyclopentyl-1-(2-methoxyethyl)-1-(3-methoxypropyl)guanidine
CID 62361861
2-Cyclopentyl-1-(1-methoxypropan-2-yl)-1-methylguanidine
CID 62362076
2-Cyclopentyl-1-cyclopropyl-1-(2-methoxyethyl)guanidine
CID 62362079
1-Butan-2-yl-2-cyclopentyl-1-(2-methoxyethyl)guanidine
CID 62362082
N'-cyclopentyl-5-ethyl-2-methylmorpholine-4-carboximidamide
CID 62362282
2-Cyclopentyl-1-ethyl-1-(oxolan-2-ylmethyl)guanidine
CID 62362285
2-Cyclopentyl-1-(2-methoxyethyl)-1-methylguanidine
CID 62362509
2-Cyclopentyl-1-(2-methoxyethyl)-1-(1-methoxypropan-2-yl)guanidine
CID 62362738

Frequently Asked Questions

What is the IUPAC name of N'-cyclopentyl-3-methoxypyrrolidine-1-carboximidamide?
The IUPAC name of N'-cyclopentyl-3-methoxypyrrolidine-1-carboximidamide (CID 103534597) is N'-cyclopentyl-3-methoxypyrrolidine-1-carboximidamide.
What is the SMILES notation for N'-cyclopentyl-3-methoxypyrrolidine-1-carboximidamide?
The canonical SMILES for N'-cyclopentyl-3-methoxypyrrolidine-1-carboximidamide is COC1CCN(/C(N)=N/C2CCCC2)C1.
What is the InChIKey of N'-cyclopentyl-3-methoxypyrrolidine-1-carboximidamide?
The InChIKey is FZQBDFUXLJAXAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c1-15-10-6-7-14(8-10)11(12)13-9-4-2-3-5-9/h9-10H,2-8H2,1H3,(H2,12,13).
What are the key properties of N'-cyclopentyl-3-methoxypyrrolidine-1-carboximidamide?
N'-cyclopentyl-3-methoxypyrrolidine-1-carboximidamide has a molecular weight of 211.31 g/mol, XLogP of 0.96, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopentyl-3-methoxypyrrolidine-1-carboximidamide is sourced from PubChem (CID 103534597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).