5-(dicyclopropylmethylamino)-N'-hydroxypentanimidamide

C12H23N3O — CID 77032523

IUPAC5-(dicyclopropylmethylamino)-N'-hydroxypentanimidamide
SMILESNC(CCCCNC(C1CC1)C1CC1)=NO
InChIInChI=1S/C12H23N3O/c13-11(15-16)3-1-2-8-14-12(9-4-5-9)10-6-7-10/h9-10,12,14,16H,1-8H2,(H2,13,15)
InChIKeyYXXWFLKBPSRARM-UHFFFAOYSA-N
MW225.34 g/mol
LogP1.68
Rot. Bonds8

About 5-(dicyclopropylmethylamino)-N'-hydroxypentanimidamide

5-(dicyclopropylmethylamino)-N'-hydroxypentanimidamide (PubChem CID 77032523) has the molecular formula C12H23N3O and a molecular weight of 225.34 g/mol. Its IUPAC name is 5-(dicyclopropylmethylamino)-N'-hydroxypentanimidamide.

Molecular Properties

Compound Name5-(dicyclopropylmethylamino)-N'-hydroxypentanimidamide
PubChem CID77032523
Molecular FormulaC12H23N3O
Molecular Weight225.34 g/mol
Exact Mass225.18
IUPAC Name5-(dicyclopropylmethylamino)-N'-hydroxypentanimidamide
SMILESNC(CCCCNC(C1CC1)C1CC1)=NO
InChIInChI=1S/C12H23N3O/c13-11(15-16)3-1-2-8-14-12(9-4-5-9)10-6-7-10/h9-10,12,14,16H,1-8H2,(H2,13,15)
InChIKeyYXXWFLKBPSRARM-UHFFFAOYSA-N
XLogP1.68
TPSA70.64 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 51.68
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'}

Analyze 5-(dicyclopropylmethylamino)-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

Related Compounds

5-[[(1R)-1-cycloheptylethyl]amino]-N'-hydroxypentanimidamide
CID 81392075
N'-hydroxy-5-(pentan-3-ylamino)pentanimidamide
CID 77026159
5-(butan-2-ylamino)-N'-hydroxypentanimidamide
CID 77026529
5-(2-cyclopropylethylamino)-N'-hydroxypentanimidamide
CID 77072404
5-(but-3-yn-2-ylamino)-N'-hydroxypentanimidamide
CID 104921688
N'-hydroxy-5-(5-methylhexan-2-ylamino)pentanimidamide
CID 77030148
N-(5-amino-5-hydroxyiminopentyl)cyclopentanecarboxamide
CID 77036807
N'-hydroxy-5-(pent-4-yn-2-ylamino)pentanimidamide
CID 104864264
N'-hydroxy-5-(octan-4-ylamino)pentanimidamide
CID 114137651
1-(5-amino-5-hydroxyiminopentyl)-3-cyclopropylurea
CID 77036914
N'-hydroxy-5-[(3-hydroxycyclopentyl)methylamino]pentanimidamide
CID 106136308
N'-hydroxy-5-(1-piperidin-1-ylpropan-2-ylamino)pentanimidamide
CID 77030734

Frequently Asked Questions

What is the IUPAC name of 5-(dicyclopropylmethylamino)-N'-hydroxypentanimidamide?
The IUPAC name of 5-(dicyclopropylmethylamino)-N'-hydroxypentanimidamide (CID 77032523) is 5-(dicyclopropylmethylamino)-N'-hydroxypentanimidamide.
What is the SMILES notation for 5-(dicyclopropylmethylamino)-N'-hydroxypentanimidamide?
The canonical SMILES for 5-(dicyclopropylmethylamino)-N'-hydroxypentanimidamide is NC(CCCCNC(C1CC1)C1CC1)=NO.
What is the InChIKey of 5-(dicyclopropylmethylamino)-N'-hydroxypentanimidamide?
The InChIKey is YXXWFLKBPSRARM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O/c13-11(15-16)3-1-2-8-14-12(9-4-5-9)10-6-7-10/h9-10,12,14,16H,1-8H2,(H2,13,15).
What are the key properties of 5-(dicyclopropylmethylamino)-N'-hydroxypentanimidamide?
5-(dicyclopropylmethylamino)-N'-hydroxypentanimidamide has a molecular weight of 225.34 g/mol, XLogP of 1.68, 8 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(dicyclopropylmethylamino)-N'-hydroxypentanimidamide is sourced from PubChem (CID 77032523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).