N'-hydroxy-2,2-dimethyl-5-(2-piperidin-1-ylpropylamino)pentanimidamide

C15H32N4O — CID 77063211

IUPACN'-hydroxy-2,2-dimethyl-5-(2-piperidin-1-ylpropylamino)pentanimidamide
SMILESCC(CNCCCC(C)(C)C(N)=NO)N1CCCCC1
InChIInChI=1S/C15H32N4O/c1-13(19-10-5-4-6-11-19)12-17-9-7-8-15(2,3)14(16)18-20/h13,17,20H,4-12H2,1-3H3,(H2,16,18)
InChIKeyXPRZFXNBLSBYLS-UHFFFAOYSA-N
MW284.45 g/mol
LogP2.00
Rot. Bonds8

About N'-hydroxy-2,2-dimethyl-5-(2-piperidin-1-ylpropylamino)pentanimidamide

N'-hydroxy-2,2-dimethyl-5-(2-piperidin-1-ylpropylamino)pentanimidamide (PubChem CID 77063211) has the molecular formula C15H32N4O and a molecular weight of 284.45 g/mol. Its IUPAC name is N'-hydroxy-2,2-dimethyl-5-(2-piperidin-1-ylpropylamino)pentanimidamide.

Molecular Properties

Compound NameN'-hydroxy-2,2-dimethyl-5-(2-piperidin-1-ylpropylamino)pentanimidamide
PubChem CID77063211
Molecular FormulaC15H32N4O
Molecular Weight284.45 g/mol
Exact Mass284.26
IUPAC NameN'-hydroxy-2,2-dimethyl-5-(2-piperidin-1-ylpropylamino)pentanimidamide
SMILESCC(CNCCCC(C)(C)C(N)=NO)N1CCCCC1
InChIInChI=1S/C15H32N4O/c1-13(19-10-5-4-6-11-19)12-17-9-7-8-15(2,3)14(16)18-20/h13,17,20H,4-12H2,1-3H3,(H2,16,18)
InChIKeyXPRZFXNBLSBYLS-UHFFFAOYSA-N
XLogP2.00
TPSA73.88 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.45
LogP ≤ 52.00
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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Related Compounds

2-methyl-4-(2-piperidin-1-ylpropylamino)butan-2-ol
CID 79361764
N-[2-(azepan-1-yl)propyl]butan-1-amine
CID 62557297
N'-hydroxy-2,2-dimethyl-4-(2,3,3-trimethylbutylamino)butanimidamide
CID 83144600
N'-hydroxy-4-[(2-hydroxy-3-methylbutyl)amino]-2,2-dimethylbutanimidamide
CID 104866839
5-(3-cyclopentylpropylamino)-N'-hydroxy-2,2-dimethylpentanimidamide
CID 106011988
N-(2-piperidin-1-ylpropyl)octan-1-amine
CID 63452848
N'-hydroxy-2,2-dimethyl-4-piperidin-1-ylbutanimidamide
CID 77062923
4-[(5-amino-5-hydroxyimino-4,4-dimethylpentyl)amino]butanamide
CID 77063642
5-[3-(dimethylamino)propylamino]-N'-hydroxy-2,2-dimethylpentanimidamide
CID 77063885
N'-hydroxy-2,2-dimethyl-5-(thian-2-ylmethylamino)pentanimidamide
CID 80600323
6-(3,3-dimethylbutylamino)-N'-hydroxy-2,2-dimethylhexanimidamide
CID 106711627
N-(3-methoxypropyl)-2-pyrrolidin-1-ylpropan-1-amine
CID 62556427

Frequently Asked Questions

What is the IUPAC name of N'-hydroxy-2,2-dimethyl-5-(2-piperidin-1-ylpropylamino)pentanimidamide?
The IUPAC name of N'-hydroxy-2,2-dimethyl-5-(2-piperidin-1-ylpropylamino)pentanimidamide (CID 77063211) is N'-hydroxy-2,2-dimethyl-5-(2-piperidin-1-ylpropylamino)pentanimidamide.
What is the SMILES notation for N'-hydroxy-2,2-dimethyl-5-(2-piperidin-1-ylpropylamino)pentanimidamide?
The canonical SMILES for N'-hydroxy-2,2-dimethyl-5-(2-piperidin-1-ylpropylamino)pentanimidamide is CC(CNCCCC(C)(C)C(N)=NO)N1CCCCC1.
What is the InChIKey of N'-hydroxy-2,2-dimethyl-5-(2-piperidin-1-ylpropylamino)pentanimidamide?
The InChIKey is XPRZFXNBLSBYLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N4O/c1-13(19-10-5-4-6-11-19)12-17-9-7-8-15(2,3)14(16)18-20/h13,17,20H,4-12H2,1-3H3,(H2,16,18).
What are the key properties of N'-hydroxy-2,2-dimethyl-5-(2-piperidin-1-ylpropylamino)pentanimidamide?
N'-hydroxy-2,2-dimethyl-5-(2-piperidin-1-ylpropylamino)pentanimidamide has a molecular weight of 284.45 g/mol, XLogP of 2.00, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxy-2,2-dimethyl-5-(2-piperidin-1-ylpropylamino)pentanimidamide is sourced from PubChem (CID 77063211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).