5-[(2,6-dimethylpiperidin-1-yl)amino]-N'-hydroxy-2,2-dimethylpentanimidamide

C14H30N4O — CID 83015947

IUPAC5-[(2,6-dimethylpiperidin-1-yl)amino]-N'-hydroxy-2,2-dimethylpentanimidamide
SMILESCC1CCCC(C)N1NCCCC(C)(C)C(N)=NO
InChIInChI=1S/C14H30N4O/c1-11-7-5-8-12(2)18(11)16-10-6-9-14(3,4)13(15)17-19/h11-12,16,19H,5-10H2,1-4H3,(H2,15,17)
InChIKeyZGQCLWVYGAPXKH-UHFFFAOYSA-N
MW270.42 g/mol
LogP2.31
Rot. Bonds6

About 5-[(2,6-dimethylpiperidin-1-yl)amino]-N'-hydroxy-2,2-dimethylpentanimidamide

5-[(2,6-dimethylpiperidin-1-yl)amino]-N'-hydroxy-2,2-dimethylpentanimidamide (PubChem CID 83015947) has the molecular formula C14H30N4O and a molecular weight of 270.42 g/mol. Its IUPAC name is 5-[(2,6-dimethylpiperidin-1-yl)amino]-N'-hydroxy-2,2-dimethylpentanimidamide.

Molecular Properties

Compound Name5-[(2,6-dimethylpiperidin-1-yl)amino]-N'-hydroxy-2,2-dimethylpentanimidamide
PubChem CID83015947
Molecular FormulaC14H30N4O
Molecular Weight270.42 g/mol
Exact Mass270.24
IUPAC Name5-[(2,6-dimethylpiperidin-1-yl)amino]-N'-hydroxy-2,2-dimethylpentanimidamide
SMILESCC1CCCC(C)N1NCCCC(C)(C)C(N)=NO
InChIInChI=1S/C14H30N4O/c1-11-7-5-8-12(2)18(11)16-10-6-9-14(3,4)13(15)17-19/h11-12,16,19H,5-10H2,1-4H3,(H2,15,17)
InChIKeyZGQCLWVYGAPXKH-UHFFFAOYSA-N
XLogP2.31
TPSA73.88 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 52.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-[(2,6-dimethylpiperidin-1-yl)amino]-N'-hydroxy-2,2-dimethylpentanimidamide?
The IUPAC name of 5-[(2,6-dimethylpiperidin-1-yl)amino]-N'-hydroxy-2,2-dimethylpentanimidamide (CID 83015947) is 5-[(2,6-dimethylpiperidin-1-yl)amino]-N'-hydroxy-2,2-dimethylpentanimidamide.
What is the SMILES notation for 5-[(2,6-dimethylpiperidin-1-yl)amino]-N'-hydroxy-2,2-dimethylpentanimidamide?
The canonical SMILES for 5-[(2,6-dimethylpiperidin-1-yl)amino]-N'-hydroxy-2,2-dimethylpentanimidamide is CC1CCCC(C)N1NCCCC(C)(C)C(N)=NO.
What is the InChIKey of 5-[(2,6-dimethylpiperidin-1-yl)amino]-N'-hydroxy-2,2-dimethylpentanimidamide?
The InChIKey is ZGQCLWVYGAPXKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N4O/c1-11-7-5-8-12(2)18(11)16-10-6-9-14(3,4)13(15)17-19/h11-12,16,19H,5-10H2,1-4H3,(H2,15,17).
What are the key properties of 5-[(2,6-dimethylpiperidin-1-yl)amino]-N'-hydroxy-2,2-dimethylpentanimidamide?
5-[(2,6-dimethylpiperidin-1-yl)amino]-N'-hydroxy-2,2-dimethylpentanimidamide has a molecular weight of 270.42 g/mol, XLogP of 2.31, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2,6-dimethylpiperidin-1-yl)amino]-N'-hydroxy-2,2-dimethylpentanimidamide is sourced from PubChem (CID 83015947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).