N-amino-N'-cyclopropyl-3-methoxypiperidine-1-carboximidamide

C10H20N4O — CID 102972042

IUPACN-amino-N'-cyclopropyl-3-methoxypiperidine-1-carboximidamide
SMILESCOC1CCCN(/C(=N/C2CC2)NN)C1
InChIInChI=1S/C10H20N4O/c1-15-9-3-2-6-14(7-9)10(13-11)12-8-4-5-8/h8-9H,2-7,11H2,1H3,(H,12,13)
InChIKeyOTMRHCQCXPUWHG-UHFFFAOYSA-N
MW212.30 g/mol
LogP0.08
Rot. Bonds2

About N-amino-N'-cyclopropyl-3-methoxypiperidine-1-carboximidamide

N-amino-N'-cyclopropyl-3-methoxypiperidine-1-carboximidamide (PubChem CID 102972042) has the molecular formula C10H20N4O and a molecular weight of 212.30 g/mol. Its IUPAC name is N-amino-N'-cyclopropyl-3-methoxypiperidine-1-carboximidamide.

Molecular Properties

Compound NameN-amino-N'-cyclopropyl-3-methoxypiperidine-1-carboximidamide
PubChem CID102972042
Molecular FormulaC10H20N4O
Molecular Weight212.30 g/mol
Exact Mass212.16
IUPAC NameN-amino-N'-cyclopropyl-3-methoxypiperidine-1-carboximidamide
SMILESCOC1CCCN(/C(=N/C2CC2)NN)C1
InChIInChI=1S/C10H20N4O/c1-15-9-3-2-6-14(7-9)10(13-11)12-8-4-5-8/h8-9H,2-7,11H2,1H3,(H,12,13)
InChIKeyOTMRHCQCXPUWHG-UHFFFAOYSA-N
XLogP0.08
TPSA62.88 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.30
LogP ≤ 50.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-amino-N'-cyclopropyl-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

N'-cyclopropyl-3-propoxypiperidine-1-carboximidamide
CID 62362798
N'-cyclopropyl-3-ethoxypiperidine-1-carboximidamide
CID 62363016
3-methoxy-N'-propan-2-ylpiperidine-1-carboximidamide
CID 102963286
N'-cyclopropyl-3-methoxypiperidine-1-carboximidamide
CID 102963294
N-amino-N'-ethyl-3-methoxy-4-methylpiperidine-1-carboximidamide
CID 102972023
N-amino-N'-cyclohexyl-3-methoxy-4-methylpiperidine-1-carboximidamide
CID 102972024
N-amino-3-methoxy-N'-(3-methoxypropyl)-4-methylpiperidine-1-carboximidamide
CID 102972025
N-amino-3-methoxy-N',4-dimethylpiperidine-1-carboximidamide
CID 102972026
N-amino-3-methoxy-4-methyl-N'-propylpiperidine-1-carboximidamide
CID 102972028
N-amino-3-methoxy-N'-(2-methoxyethyl)-4-methylpiperidine-1-carboximidamide
CID 102972029
N-amino-N'-cyclopropyl-3-methoxy-4-methylpiperidine-1-carboximidamide
CID 102972030
N-amino-3-methoxy-4-methyl-N'-propan-2-ylpiperidine-1-carboximidamide
CID 102972032

Frequently Asked Questions

What is the IUPAC name of N-amino-N'-cyclopropyl-3-methoxypiperidine-1-carboximidamide?
The IUPAC name of N-amino-N'-cyclopropyl-3-methoxypiperidine-1-carboximidamide (CID 102972042) is N-amino-N'-cyclopropyl-3-methoxypiperidine-1-carboximidamide.
What is the SMILES notation for N-amino-N'-cyclopropyl-3-methoxypiperidine-1-carboximidamide?
The canonical SMILES for N-amino-N'-cyclopropyl-3-methoxypiperidine-1-carboximidamide is COC1CCCN(/C(=N/C2CC2)NN)C1.
What is the InChIKey of N-amino-N'-cyclopropyl-3-methoxypiperidine-1-carboximidamide?
The InChIKey is OTMRHCQCXPUWHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N4O/c1-15-9-3-2-6-14(7-9)10(13-11)12-8-4-5-8/h8-9H,2-7,11H2,1H3,(H,12,13).
What are the key properties of N-amino-N'-cyclopropyl-3-methoxypiperidine-1-carboximidamide?
N-amino-N'-cyclopropyl-3-methoxypiperidine-1-carboximidamide has a molecular weight of 212.30 g/mol, XLogP of 0.08, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-amino-N'-cyclopropyl-3-methoxypiperidine-1-carboximidamide is sourced from PubChem (CID 102972042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).