N'-hydroxy-5-[(1-methylcyclopentyl)amino]pentanimidamide

C11H23N3O — CID 77030789

IUPACN'-hydroxy-5-[(1-methylcyclopentyl)amino]pentanimidamide
SMILESCC1(NCCCCC(N)=NO)CCCC1
InChIInChI=1S/C11H23N3O/c1-11(7-3-4-8-11)13-9-5-2-6-10(12)14-15/h13,15H,2-9H2,1H3,(H2,12,14)
InChIKeyRUSOAVJBVJQSBS-UHFFFAOYSA-N
MW213.32 g/mol
LogP1.83
Rot. Bonds6

About N'-hydroxy-5-[(1-methylcyclopentyl)amino]pentanimidamide

N'-hydroxy-5-[(1-methylcyclopentyl)amino]pentanimidamide (PubChem CID 77030789) has the molecular formula C11H23N3O and a molecular weight of 213.32 g/mol. Its IUPAC name is N'-hydroxy-5-[(1-methylcyclopentyl)amino]pentanimidamide.

Molecular Properties

Compound NameN'-hydroxy-5-[(1-methylcyclopentyl)amino]pentanimidamide
PubChem CID77030789
Molecular FormulaC11H23N3O
Molecular Weight213.32 g/mol
Exact Mass213.18
IUPAC NameN'-hydroxy-5-[(1-methylcyclopentyl)amino]pentanimidamide
SMILESCC1(NCCCCC(N)=NO)CCCC1
InChIInChI=1S/C11H23N3O/c1-11(7-3-4-8-11)13-9-5-2-6-10(12)14-15/h13,15H,2-9H2,1H3,(H2,12,14)
InChIKeyRUSOAVJBVJQSBS-UHFFFAOYSA-N
XLogP1.83
TPSA70.64 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 51.83
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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 N'-hydroxy-5-[(1-methylcyclopentyl)amino]pentanimidamide?
The IUPAC name of N'-hydroxy-5-[(1-methylcyclopentyl)amino]pentanimidamide (CID 77030789) is N'-hydroxy-5-[(1-methylcyclopentyl)amino]pentanimidamide.
What is the SMILES notation for N'-hydroxy-5-[(1-methylcyclopentyl)amino]pentanimidamide?
The canonical SMILES for N'-hydroxy-5-[(1-methylcyclopentyl)amino]pentanimidamide is CC1(NCCCCC(N)=NO)CCCC1.
What is the InChIKey of N'-hydroxy-5-[(1-methylcyclopentyl)amino]pentanimidamide?
The InChIKey is RUSOAVJBVJQSBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O/c1-11(7-3-4-8-11)13-9-5-2-6-10(12)14-15/h13,15H,2-9H2,1H3,(H2,12,14).
What are the key properties of N'-hydroxy-5-[(1-methylcyclopentyl)amino]pentanimidamide?
N'-hydroxy-5-[(1-methylcyclopentyl)amino]pentanimidamide has a molecular weight of 213.32 g/mol, XLogP of 1.83, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxy-5-[(1-methylcyclopentyl)amino]pentanimidamide is sourced from PubChem (CID 77030789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).