4-tert-butyl-N'-hydroxypiperidine-1-carboximidamide

C10H21N3O — CID 20718024

IUPAC4-tert-butyl-N'-hydroxypiperidine-1-carboximidamide
SMILESCC(C)(C)C1CCN(/C(N)=N/O)CC1
InChIInChI=1S/C10H21N3O/c1-10(2,3)8-4-6-13(7-5-8)9(11)12-14/h8,14H,4-7H2,1-3H3,(H2,11,12)
InChIKeyCYWVPILRDHMDBS-UHFFFAOYSA-N
MW199.30 g/mol
LogP1.45
Rot. Bonds

About 4-tert-butyl-N'-hydroxypiperidine-1-carboximidamide

4-tert-butyl-N'-hydroxypiperidine-1-carboximidamide (PubChem CID 20718024) has the molecular formula C10H21N3O and a molecular weight of 199.30 g/mol. Its IUPAC name is 4-tert-butyl-N'-hydroxypiperidine-1-carboximidamide.

Molecular Properties

Compound Name4-tert-butyl-N'-hydroxypiperidine-1-carboximidamide
PubChem CID20718024
Molecular FormulaC10H21N3O
Molecular Weight199.30 g/mol
Exact Mass199.17
IUPAC Name4-tert-butyl-N'-hydroxypiperidine-1-carboximidamide
SMILESCC(C)(C)C1CCN(/C(N)=N/O)CC1
InChIInChI=1S/C10H21N3O/c1-10(2,3)8-4-6-13(7-5-8)9(11)12-14/h8,14H,4-7H2,1-3H3,(H2,11,12)
InChIKeyCYWVPILRDHMDBS-UHFFFAOYSA-N
XLogP1.45
TPSA61.85 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.30
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 4-tert-butyl-N'-hydroxypiperidine-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

4-Tert-butylpiperidine-1-carboximidamide
CID 20587961
4-Propan-2-ylpiperidine-1-carboximidamide
CID 21018809
4-(2,2-Dimethylpropyl)piperidine-1-carboximidamide
CID 57588648
(4-Tert-butylpiperidine-1-carboximidoyl)azanide;yttrium
CID 59063645
N-Hydroxy-4-methylpiperidine-1-carboximidamide
CID 62482278
N-hydroxy-3-methylpiperidine-1-carboximidamide
CID 62483093
N'-hydroxy-4-propylpiperidine-1-carboximidamide
CID 62483528
N'-hydroxy-4-methylpiperidine-1-carboximidamide
CID 73851569
CID 76944390
CID 76944390
N'-hydroxy-3,3-dimethylpiperidine-1-carboximidamide
CID 77016547
4-Tert-butylpiperidine-1-carboximidamide;ethane
CID 142970551
1-Hydroxy-3,3,4,5-tetramethylpiperidin-2-imine
CID 143150178

Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-N'-hydroxypiperidine-1-carboximidamide?
The IUPAC name of 4-tert-butyl-N'-hydroxypiperidine-1-carboximidamide (CID 20718024) is 4-tert-butyl-N'-hydroxypiperidine-1-carboximidamide.
What is the SMILES notation for 4-tert-butyl-N'-hydroxypiperidine-1-carboximidamide?
The canonical SMILES for 4-tert-butyl-N'-hydroxypiperidine-1-carboximidamide is CC(C)(C)C1CCN(/C(N)=N/O)CC1.
What is the InChIKey of 4-tert-butyl-N'-hydroxypiperidine-1-carboximidamide?
The InChIKey is CYWVPILRDHMDBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O/c1-10(2,3)8-4-6-13(7-5-8)9(11)12-14/h8,14H,4-7H2,1-3H3,(H2,11,12).
What are the key properties of 4-tert-butyl-N'-hydroxypiperidine-1-carboximidamide?
4-tert-butyl-N'-hydroxypiperidine-1-carboximidamide has a molecular weight of 199.30 g/mol, XLogP of 1.45, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-N'-hydroxypiperidine-1-carboximidamide is sourced from PubChem (CID 20718024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).