N'-cyclopentyl-3-methoxypiperidine-1-carboximidamide

C12H23N3O — CID 102963280

IUPACN'-cyclopentyl-3-methoxypiperidine-1-carboximidamide
SMILESCOC1CCCN(/C(N)=N/C2CCCC2)C1
InChIInChI=1S/C12H23N3O/c1-16-11-7-4-8-15(9-11)12(13)14-10-5-2-3-6-10/h10-11H,2-9H2,1H3,(H2,13,14)
InChIKeyWSGKRGACXDUHNC-UHFFFAOYSA-N
MW225.34 g/mol
LogP1.35
Rot. Bonds2

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

N'-cyclopentyl-3-methoxypiperidine-1-carboximidamide (PubChem CID 102963280) has the molecular formula C12H23N3O and a molecular weight of 225.34 g/mol. Its IUPAC name is N'-cyclopentyl-3-methoxypiperidine-1-carboximidamide.

Molecular Properties

Compound NameN'-cyclopentyl-3-methoxypiperidine-1-carboximidamide
PubChem CID102963280
Molecular FormulaC12H23N3O
Molecular Weight225.34 g/mol
Exact Mass225.18
IUPAC NameN'-cyclopentyl-3-methoxypiperidine-1-carboximidamide
SMILESCOC1CCCN(/C(N)=N/C2CCCC2)C1
InChIInChI=1S/C12H23N3O/c1-16-11-7-4-8-15(9-11)12(13)14-10-5-2-3-6-10/h10-11H,2-9H2,1H3,(H2,13,14)
InChIKeyWSGKRGACXDUHNC-UHFFFAOYSA-N
XLogP1.35
TPSA50.85 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 51.35
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'-cyclopentyl-3-methoxypiperidine-1-carboximidamide with MolForge

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

Launch Full Analysis

Related Compounds

2-Cyclopentyl-1-methyl-1-(oxan-2-ylmethyl)guanidine
CID 55063680
N'-tert-butyl-3-propoxypiperidine-1-carboximidamide
CID 55063809
N'-cyclopentyl-3-propoxypiperidine-1-carboximidamide
CID 55063963
N'-cyclohexyl-3-ethoxypiperidine-1-carboximidamide
CID 55064006
3-Propoxypiperidine-1-carboximidamide
CID 61573275
3-Ethoxypiperidine-1-carboximidamide
CID 61573303
N'-methyl-3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazine-4-carboximidamide
CID 62358603
5-ethyl-N',2-dimethylmorpholine-4-carboximidamide
CID 62359519
N',2,5-trimethylmorpholine-4-carboximidamide
CID 62360427
N'-methyl-3-propoxypiperidine-1-carboximidamide
CID 62360806
2,6-dimethyl-N'-propan-2-ylmorpholine-4-carboximidamide
CID 62360849
2-methyl-N'-propan-2-ylmorpholine-4-carboximidamide
CID 62360854

Frequently Asked Questions

What is the IUPAC name of N'-cyclopentyl-3-methoxypiperidine-1-carboximidamide?
The IUPAC name of N'-cyclopentyl-3-methoxypiperidine-1-carboximidamide (CID 102963280) is N'-cyclopentyl-3-methoxypiperidine-1-carboximidamide.
What is the SMILES notation for N'-cyclopentyl-3-methoxypiperidine-1-carboximidamide?
The canonical SMILES for N'-cyclopentyl-3-methoxypiperidine-1-carboximidamide is COC1CCCN(/C(N)=N/C2CCCC2)C1.
What is the InChIKey of N'-cyclopentyl-3-methoxypiperidine-1-carboximidamide?
The InChIKey is WSGKRGACXDUHNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O/c1-16-11-7-4-8-15(9-11)12(13)14-10-5-2-3-6-10/h10-11H,2-9H2,1H3,(H2,13,14).
What are the key properties of N'-cyclopentyl-3-methoxypiperidine-1-carboximidamide?
N'-cyclopentyl-3-methoxypiperidine-1-carboximidamide has a molecular weight of 225.34 g/mol, XLogP of 1.35, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopentyl-3-methoxypiperidine-1-carboximidamide is sourced from PubChem (CID 102963280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).