N'-(oxolan-3-ylmethyl)cyclopentanecarboximidamide

C11H20N2O — CID 63174334

IUPACN'-(oxolan-3-ylmethyl)cyclopentanecarboximidamide
SMILESN/C(=N\CC1CCOC1)C1CCCC1
InChIInChI=1S/C11H20N2O/c12-11(10-3-1-2-4-10)13-7-9-5-6-14-8-9/h9-10H,1-8H2,(H2,12,13)
InChIKeyYOULXOSUKGTOKW-UHFFFAOYSA-N
MW196.29 g/mol
LogP1.57
Rot. Bonds3

About N'-(oxolan-3-ylmethyl)cyclopentanecarboximidamide

N'-(oxolan-3-ylmethyl)cyclopentanecarboximidamide (PubChem CID 63174334) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is N'-(oxolan-3-ylmethyl)cyclopentanecarboximidamide.

Molecular Properties

Compound NameN'-(oxolan-3-ylmethyl)cyclopentanecarboximidamide
PubChem CID63174334
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC NameN'-(oxolan-3-ylmethyl)cyclopentanecarboximidamide
SMILESN/C(=N\CC1CCOC1)C1CCCC1
InChIInChI=1S/C11H20N2O/c12-11(10-3-1-2-4-10)13-7-9-5-6-14-8-9/h9-10H,1-8H2,(H2,12,13)
InChIKeyYOULXOSUKGTOKW-UHFFFAOYSA-N
XLogP1.57
TPSA47.61 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 51.57
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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Frequently Asked Questions

What is the IUPAC name of N'-(oxolan-3-ylmethyl)cyclopentanecarboximidamide?
The IUPAC name of N'-(oxolan-3-ylmethyl)cyclopentanecarboximidamide (CID 63174334) is N'-(oxolan-3-ylmethyl)cyclopentanecarboximidamide.
What is the SMILES notation for N'-(oxolan-3-ylmethyl)cyclopentanecarboximidamide?
The canonical SMILES for N'-(oxolan-3-ylmethyl)cyclopentanecarboximidamide is N/C(=N\CC1CCOC1)C1CCCC1.
What is the InChIKey of N'-(oxolan-3-ylmethyl)cyclopentanecarboximidamide?
The InChIKey is YOULXOSUKGTOKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c12-11(10-3-1-2-4-10)13-7-9-5-6-14-8-9/h9-10H,1-8H2,(H2,12,13).
What are the key properties of N'-(oxolan-3-ylmethyl)cyclopentanecarboximidamide?
N'-(oxolan-3-ylmethyl)cyclopentanecarboximidamide has a molecular weight of 196.29 g/mol, XLogP of 1.57, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(oxolan-3-ylmethyl)cyclopentanecarboximidamide is sourced from PubChem (CID 63174334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).