N'-hydroxy-4-[[1-(hydroxymethyl)cyclopentyl]amino]butanimidamide

C10H21N3O2 — CID 77028665

IUPACN'-hydroxy-4-[[1-(hydroxymethyl)cyclopentyl]amino]butanimidamide
SMILESNC(CCCNC1(CO)CCCC1)=NO
InChIInChI=1S/C10H21N3O2/c11-9(13-15)4-3-7-12-10(8-14)5-1-2-6-10/h12,14-15H,1-8H2,(H2,11,13)
InChIKeyBUKVSZJSZNJRDW-UHFFFAOYSA-N
MW215.30 g/mol
LogP0.41
Rot. Bonds6

About N'-hydroxy-4-[[1-(hydroxymethyl)cyclopentyl]amino]butanimidamide

N'-hydroxy-4-[[1-(hydroxymethyl)cyclopentyl]amino]butanimidamide (PubChem CID 77028665) has the molecular formula C10H21N3O2 and a molecular weight of 215.30 g/mol. Its IUPAC name is N'-hydroxy-4-[[1-(hydroxymethyl)cyclopentyl]amino]butanimidamide.

Molecular Properties

Compound NameN'-hydroxy-4-[[1-(hydroxymethyl)cyclopentyl]amino]butanimidamide
PubChem CID77028665
Molecular FormulaC10H21N3O2
Molecular Weight215.30 g/mol
Exact Mass215.16
IUPAC NameN'-hydroxy-4-[[1-(hydroxymethyl)cyclopentyl]amino]butanimidamide
SMILESNC(CCCNC1(CO)CCCC1)=NO
InChIInChI=1S/C10H21N3O2/c11-9(13-15)4-3-7-12-10(8-14)5-1-2-6-10/h12,14-15H,1-8H2,(H2,11,13)
InChIKeyBUKVSZJSZNJRDW-UHFFFAOYSA-N
XLogP0.41
TPSA90.87 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 50.41
H-Bond Donors ≤ 54
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 N'-hydroxy-4-[[1-(hydroxymethyl)cyclopentyl]amino]butanimidamide 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

3,3,3-trifluoro-N'-hydroxy-2-[[[1-(hydroxymethyl)cyclopentyl]amino]methyl]propanimidamide
CID 113807989
N'-hydroxy-3-[[1-(hydroxymethyl)cyclopentyl]amino]propanimidamide
CID 77027612
N'-hydroxy-3-[[1-(hydroxymethyl)cyclopentyl]amino]-2-methylpropanimidamide
CID 77027613
N'-hydroxy-3-[[1-(hydroxymethyl)cyclopentyl]amino]butanimidamide
CID 77027818
N'-hydroxy-5-[3-(hydroxymethyl)pentan-3-ylamino]pentanimidamide
CID 77028028
N'-hydroxy-5-[[1-(hydroxymethyl)cyclopentyl]amino]pentanimidamide
CID 77028029
N'-hydroxy-2-[[1-(hydroxymethyl)cyclopentyl]amino]ethanimidamide
CID 77028238
N'-hydroxy-3-[[1-(hydroxymethyl)cyclopentyl]amino]pentanimidamide
CID 77028240
N'-hydroxy-3-[3-(hydroxymethyl)pentan-3-ylamino]pentanimidamide
CID 77028447
N'-hydroxy-2-[[1-(hydroxymethyl)cyclopentyl]amino]butanimidamide
CID 77028451
N'-hydroxy-4-[3-(hydroxymethyl)pentan-3-ylamino]butanimidamide
CID 77028663
N'-hydroxy-3-[[1-(hydroxymethyl)cyclohexyl]amino]propanimidamide
CID 77028872

Frequently Asked Questions

What is the IUPAC name of N'-hydroxy-4-[[1-(hydroxymethyl)cyclopentyl]amino]butanimidamide?
The IUPAC name of N'-hydroxy-4-[[1-(hydroxymethyl)cyclopentyl]amino]butanimidamide (CID 77028665) is N'-hydroxy-4-[[1-(hydroxymethyl)cyclopentyl]amino]butanimidamide.
What is the SMILES notation for N'-hydroxy-4-[[1-(hydroxymethyl)cyclopentyl]amino]butanimidamide?
The canonical SMILES for N'-hydroxy-4-[[1-(hydroxymethyl)cyclopentyl]amino]butanimidamide is NC(CCCNC1(CO)CCCC1)=NO.
What is the InChIKey of N'-hydroxy-4-[[1-(hydroxymethyl)cyclopentyl]amino]butanimidamide?
The InChIKey is BUKVSZJSZNJRDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O2/c11-9(13-15)4-3-7-12-10(8-14)5-1-2-6-10/h12,14-15H,1-8H2,(H2,11,13).
What are the key properties of N'-hydroxy-4-[[1-(hydroxymethyl)cyclopentyl]amino]butanimidamide?
N'-hydroxy-4-[[1-(hydroxymethyl)cyclopentyl]amino]butanimidamide has a molecular weight of 215.30 g/mol, XLogP of 0.41, 6 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxy-4-[[1-(hydroxymethyl)cyclopentyl]amino]butanimidamide is sourced from PubChem (CID 77028665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).