N'-(oxan-4-yl)cyclopentanecarboximidamide

C11H20N2O — CID 63176227

IUPACN'-(oxan-4-yl)cyclopentanecarboximidamide
SMILESN/C(=N\C1CCOCC1)C1CCCC1
InChIInChI=1S/C11H20N2O/c12-11(9-3-1-2-4-9)13-10-5-7-14-8-6-10/h9-10H,1-8H2,(H2,12,13)
InChIKeyYDWDBWQEXOSTOK-UHFFFAOYSA-N
MW196.29 g/mol
LogP1.71
Rot. Bonds2

About N'-(oxan-4-yl)cyclopentanecarboximidamide

N'-(oxan-4-yl)cyclopentanecarboximidamide (PubChem CID 63176227) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is N'-(oxan-4-yl)cyclopentanecarboximidamide.

Molecular Properties

Compound NameN'-(oxan-4-yl)cyclopentanecarboximidamide
PubChem CID63176227
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC NameN'-(oxan-4-yl)cyclopentanecarboximidamide
SMILESN/C(=N\C1CCOCC1)C1CCCC1
InChIInChI=1S/C11H20N2O/c12-11(9-3-1-2-4-9)13-10-5-7-14-8-6-10/h9-10H,1-8H2,(H2,12,13)
InChIKeyYDWDBWQEXOSTOK-UHFFFAOYSA-N
XLogP1.71
TPSA47.61 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 51.71
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'}

Analyze N'-(oxan-4-yl)cyclopentanecarboximidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N'-(oxan-4-yl)cyclopentanecarboximidamide?
The IUPAC name of N'-(oxan-4-yl)cyclopentanecarboximidamide (CID 63176227) is N'-(oxan-4-yl)cyclopentanecarboximidamide.
What is the SMILES notation for N'-(oxan-4-yl)cyclopentanecarboximidamide?
The canonical SMILES for N'-(oxan-4-yl)cyclopentanecarboximidamide is N/C(=N\C1CCOCC1)C1CCCC1.
What is the InChIKey of N'-(oxan-4-yl)cyclopentanecarboximidamide?
The InChIKey is YDWDBWQEXOSTOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c12-11(9-3-1-2-4-9)13-10-5-7-14-8-6-10/h9-10H,1-8H2,(H2,12,13).
What are the key properties of N'-(oxan-4-yl)cyclopentanecarboximidamide?
N'-(oxan-4-yl)cyclopentanecarboximidamide has a molecular weight of 196.29 g/mol, XLogP of 1.71, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(oxan-4-yl)cyclopentanecarboximidamide is sourced from PubChem (CID 63176227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).