5-[cyclopentyl(2-hydroxyethyl)amino]-N'-hydroxypentanimidamide

C12H25N3O2 — CID 54994033

IUPAC5-[cyclopentyl(2-hydroxyethyl)amino]-N'-hydroxypentanimidamide
SMILESN/C(CCCCN(CCO)C1CCCC1)=N/O
InChIInChI=1S/C12H25N3O2/c13-12(14-17)7-3-4-8-15(9-10-16)11-5-1-2-6-11/h11,16-17H,1-10H2,(H2,13,14)
InChIKeyDGWBVJULCZQDGX-UHFFFAOYSA-N
MW243.35 g/mol
LogP1.14
Rot. Bonds8

About 5-[cyclopentyl(2-hydroxyethyl)amino]-N'-hydroxypentanimidamide

5-[cyclopentyl(2-hydroxyethyl)amino]-N'-hydroxypentanimidamide (PubChem CID 54994033) has the molecular formula C12H25N3O2 and a molecular weight of 243.35 g/mol. Its IUPAC name is 5-[cyclopentyl(2-hydroxyethyl)amino]-N'-hydroxypentanimidamide.

Molecular Properties

Compound Name5-[cyclopentyl(2-hydroxyethyl)amino]-N'-hydroxypentanimidamide
PubChem CID54994033
Molecular FormulaC12H25N3O2
Molecular Weight243.35 g/mol
Exact Mass243.19
IUPAC Name5-[cyclopentyl(2-hydroxyethyl)amino]-N'-hydroxypentanimidamide
SMILESN/C(CCCCN(CCO)C1CCCC1)=N/O
InChIInChI=1S/C12H25N3O2/c13-12(14-17)7-3-4-8-15(9-10-16)11-5-1-2-6-11/h11,16-17H,1-10H2,(H2,13,14)
InChIKeyDGWBVJULCZQDGX-UHFFFAOYSA-N
XLogP1.14
TPSA82.08 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 51.14
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'}

Analyze 5-[cyclopentyl(2-hydroxyethyl)amino]-N'-hydroxypentanimidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-[cyclopentyl(2-hydroxyethyl)amino]-N'-hydroxypentanimidamide?
The IUPAC name of 5-[cyclopentyl(2-hydroxyethyl)amino]-N'-hydroxypentanimidamide (CID 54994033) is 5-[cyclopentyl(2-hydroxyethyl)amino]-N'-hydroxypentanimidamide.
What is the SMILES notation for 5-[cyclopentyl(2-hydroxyethyl)amino]-N'-hydroxypentanimidamide?
The canonical SMILES for 5-[cyclopentyl(2-hydroxyethyl)amino]-N'-hydroxypentanimidamide is N/C(CCCCN(CCO)C1CCCC1)=N/O.
What is the InChIKey of 5-[cyclopentyl(2-hydroxyethyl)amino]-N'-hydroxypentanimidamide?
The InChIKey is DGWBVJULCZQDGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O2/c13-12(14-17)7-3-4-8-15(9-10-16)11-5-1-2-6-11/h11,16-17H,1-10H2,(H2,13,14).
What are the key properties of 5-[cyclopentyl(2-hydroxyethyl)amino]-N'-hydroxypentanimidamide?
5-[cyclopentyl(2-hydroxyethyl)amino]-N'-hydroxypentanimidamide has a molecular weight of 243.35 g/mol, XLogP of 1.14, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[cyclopentyl(2-hydroxyethyl)amino]-N'-hydroxypentanimidamide is sourced from PubChem (CID 54994033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).