(4-tert-butylpiperidine-1-carboximidoyl)azanide;yttrium

C10H20N3Y- — CID 59063645

IUPAC(4-tert-butylpiperidine-1-carboximidoyl)azanide;yttrium
SMILES[H]/N=C(\[NH-])N1CCC(C(C)(C)C)CC1.[Y]
InChIInChI=1S/C10H20N3.Y/c1-10(2,3)8-4-6-13(7-5-8)9(11)12;/h8H,4-7H2,1-3H3,(H2-,11,12);/q-1;
InChIKeyFQLIJLSWYQAOCP-UHFFFAOYSA-N
MW271.20 g/mol
LogP2.73
Rot. Bonds

About (4-tert-butylpiperidine-1-carboximidoyl)azanide;yttrium

(4-tert-butylpiperidine-1-carboximidoyl)azanide;yttrium (PubChem CID 59063645) has the molecular formula C10H20N3Y- and a molecular weight of 271.20 g/mol. Its IUPAC name is (4-tert-butylpiperidine-1-carboximidoyl)azanide;yttrium.

Molecular Properties

Compound Name(4-tert-butylpiperidine-1-carboximidoyl)azanide;yttrium
PubChem CID59063645
Molecular FormulaC10H20N3Y-
Molecular Weight271.20 g/mol
Exact Mass271.07
IUPAC Name(4-tert-butylpiperidine-1-carboximidoyl)azanide;yttrium
SMILES[H]/N=C(\[NH-])N1CCC(C(C)(C)C)CC1.[Y]
InChIInChI=1S/C10H20N3.Y/c1-10(2,3)8-4-6-13(7-5-8)9(11)12;/h8H,4-7H2,1-3H3,(H2-,11,12);/q-1;
InChIKeyFQLIJLSWYQAOCP-UHFFFAOYSA-N
XLogP2.73
TPSA50.89 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.20
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze (4-tert-butylpiperidine-1-carboximidoyl)azanide;yttrium 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-Methylpiperidine-1-carboximidamide
CID 3056395
3-Methylpiperidine-1-carboximidamide
CID 12011844
4-(Fluoromethyl)-4-methylpiperidine-1-carboximidamide
CID 121203180
4-Tert-butylpiperidine-1-carboximidamide
CID 20587961
4-tert-butyl-N,N'-dimethylpiperidine-1-carboximidamide
CID 20592815
1-(4-Tert-butylpiperidin-1-yl)ethanimine
CID 20718019
4-tert-butyl-N'-hydroxypiperidine-1-carboximidamide
CID 20718024
4-(3-Methylbutyl)piperidine-1-carboximidamide
CID 21018807
4-Propan-2-ylpiperidine-1-carboximidamide
CID 21018809
3-Ethylpiperidine-1-carboximidamide
CID 43584617
3-Methyl-piperidine-1-carboxamidine hydrochloride
CID 46736522
N,N-dicarbamimidoyl-4-methylpiperidine-1-carboximidamide
CID 54410657

Frequently Asked Questions

What is the IUPAC name of (4-tert-butylpiperidine-1-carboximidoyl)azanide;yttrium?
The IUPAC name of (4-tert-butylpiperidine-1-carboximidoyl)azanide;yttrium (CID 59063645) is (4-tert-butylpiperidine-1-carboximidoyl)azanide;yttrium.
What is the SMILES notation for (4-tert-butylpiperidine-1-carboximidoyl)azanide;yttrium?
The canonical SMILES for (4-tert-butylpiperidine-1-carboximidoyl)azanide;yttrium is [H]/N=C(\[NH-])N1CCC(C(C)(C)C)CC1.[Y].
What is the InChIKey of (4-tert-butylpiperidine-1-carboximidoyl)azanide;yttrium?
The InChIKey is FQLIJLSWYQAOCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N3.Y/c1-10(2,3)8-4-6-13(7-5-8)9(11)12;/h8H,4-7H2,1-3H3,(H2-,11,12);/q-1;.
What are the key properties of (4-tert-butylpiperidine-1-carboximidoyl)azanide;yttrium?
(4-tert-butylpiperidine-1-carboximidoyl)azanide;yttrium has a molecular weight of 271.20 g/mol, XLogP of 2.73, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-tert-butylpiperidine-1-carboximidoyl)azanide;yttrium is sourced from PubChem (CID 59063645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).