3-[(3-ethyl-2-methylcyclopentyl)amino]-N'-hydroxypropanimidamide

C11H23N3O — CID 77050582

IUPAC3-[(3-ethyl-2-methylcyclopentyl)amino]-N'-hydroxypropanimidamide
SMILESCCC1CCC(NCCC(N)=NO)C1C
InChIInChI=1S/C11H23N3O/c1-3-9-4-5-10(8(9)2)13-7-6-11(12)14-15/h8-10,13,15H,3-7H2,1-2H3,(H2,12,14)
InChIKeyOHDXACNLDMQURQ-UHFFFAOYSA-N
MW213.32 g/mol
LogP1.54
Rot. Bonds5

About 3-[(3-ethyl-2-methylcyclopentyl)amino]-N'-hydroxypropanimidamide

3-[(3-ethyl-2-methylcyclopentyl)amino]-N'-hydroxypropanimidamide (PubChem CID 77050582) has the molecular formula C11H23N3O and a molecular weight of 213.32 g/mol. Its IUPAC name is 3-[(3-ethyl-2-methylcyclopentyl)amino]-N'-hydroxypropanimidamide.

Molecular Properties

Compound Name3-[(3-ethyl-2-methylcyclopentyl)amino]-N'-hydroxypropanimidamide
PubChem CID77050582
Molecular FormulaC11H23N3O
Molecular Weight213.32 g/mol
Exact Mass213.18
IUPAC Name3-[(3-ethyl-2-methylcyclopentyl)amino]-N'-hydroxypropanimidamide
SMILESCCC1CCC(NCCC(N)=NO)C1C
InChIInChI=1S/C11H23N3O/c1-3-9-4-5-10(8(9)2)13-7-6-11(12)14-15/h8-10,13,15H,3-7H2,1-2H3,(H2,12,14)
InChIKeyOHDXACNLDMQURQ-UHFFFAOYSA-N
XLogP1.54
TPSA70.64 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 51.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'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 3-[(3-ethyl-2-methylcyclopentyl)amino]-N'-hydroxypropanimidamide 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-ethyl-2-methylcyclopentyl)amino]-N'-hydroxypentanimidamide
CID 77050586
2-[(3-ethyl-2-methylcyclopentyl)amino]-N'-hydroxypropanimidamide
CID 77050570
3-[(3-ethyl-2-methylcyclopentyl)amino]-2-methylpropanamide
CID 64921181
3-ethyl-2-methyl-N-pent-4-enylcyclopentan-1-amine
CID 64920630
N'-hydroxy-4-[(2-methylcycloheptyl)amino]butanimidamide
CID 77073768
methyl 2-[(3-ethyl-2-methylcyclopentyl)amino]acetate
CID 64920601
2-[(3-ethyl-2-methylcyclopentyl)amino]-N-methylacetamide
CID 64921195
N-cyclooctyl-N'-(3-ethyl-2-methylcyclohexyl)ethane-1,2-diamine
CID 67990591
3-[(2-ethylcyclohexyl)amino]propanamide
CID 61466861
6-[(2-ethylcyclohexyl)amino]-N'-hydroxy-2,2-dimethylhexanimidamide
CID 106711286
6-[(3-ethyl-2-methylcyclopentyl)amino]-2,2-dimethylhexanenitrile
CID 106709376
ethyl 3-[(3-ethyl-2-methylcyclopentyl)amino]-2-methylpropanoate
CID 64921594

Frequently Asked Questions

What is the IUPAC name of 3-[(3-ethyl-2-methylcyclopentyl)amino]-N'-hydroxypropanimidamide?
The IUPAC name of 3-[(3-ethyl-2-methylcyclopentyl)amino]-N'-hydroxypropanimidamide (CID 77050582) is 3-[(3-ethyl-2-methylcyclopentyl)amino]-N'-hydroxypropanimidamide.
What is the SMILES notation for 3-[(3-ethyl-2-methylcyclopentyl)amino]-N'-hydroxypropanimidamide?
The canonical SMILES for 3-[(3-ethyl-2-methylcyclopentyl)amino]-N'-hydroxypropanimidamide is CCC1CCC(NCCC(N)=NO)C1C.
What is the InChIKey of 3-[(3-ethyl-2-methylcyclopentyl)amino]-N'-hydroxypropanimidamide?
The InChIKey is OHDXACNLDMQURQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O/c1-3-9-4-5-10(8(9)2)13-7-6-11(12)14-15/h8-10,13,15H,3-7H2,1-2H3,(H2,12,14).
What are the key properties of 3-[(3-ethyl-2-methylcyclopentyl)amino]-N'-hydroxypropanimidamide?
3-[(3-ethyl-2-methylcyclopentyl)amino]-N'-hydroxypropanimidamide has a molecular weight of 213.32 g/mol, XLogP of 1.54, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-ethyl-2-methylcyclopentyl)amino]-N'-hydroxypropanimidamide is sourced from PubChem (CID 77050582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).