2-[cyclopentyl-[2-(dimethylamino)ethyl]amino]-N'-hydroxyethanimidamide

C11H24N4O — CID 77037907

IUPAC2-[cyclopentyl-[2-(dimethylamino)ethyl]amino]-N'-hydroxyethanimidamide
SMILESCN(C)CCN(CC(N)=NO)C1CCCC1
InChIInChI=1S/C11H24N4O/c1-14(2)7-8-15(9-11(12)13-16)10-5-3-4-6-10/h10,16H,3-9H2,1-2H3,(H2,12,13)
InChIKeyVOMXIUSJXPAYKJ-UHFFFAOYSA-N
MW228.34 g/mol
LogP0.54
Rot. Bonds6

About 2-[cyclopentyl-[2-(dimethylamino)ethyl]amino]-N'-hydroxyethanimidamide

2-[cyclopentyl-[2-(dimethylamino)ethyl]amino]-N'-hydroxyethanimidamide (PubChem CID 77037907) has the molecular formula C11H24N4O and a molecular weight of 228.34 g/mol. Its IUPAC name is 2-[cyclopentyl-[2-(dimethylamino)ethyl]amino]-N'-hydroxyethanimidamide.

Molecular Properties

Compound Name2-[cyclopentyl-[2-(dimethylamino)ethyl]amino]-N'-hydroxyethanimidamide
PubChem CID77037907
Molecular FormulaC11H24N4O
Molecular Weight228.34 g/mol
Exact Mass228.20
IUPAC Name2-[cyclopentyl-[2-(dimethylamino)ethyl]amino]-N'-hydroxyethanimidamide
SMILESCN(C)CCN(CC(N)=NO)C1CCCC1
InChIInChI=1S/C11H24N4O/c1-14(2)7-8-15(9-11(12)13-16)10-5-3-4-6-10/h10,16H,3-9H2,1-2H3,(H2,12,13)
InChIKeyVOMXIUSJXPAYKJ-UHFFFAOYSA-N
XLogP0.54
TPSA65.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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'}

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Related Compounds

2-[cyclopentyl(cyclopentylmethyl)amino]-N'-hydroxyethanimidamide
CID 77044633
2-[cyclopentyl(hexyl)amino]-N'-hydroxyethanimidamide
CID 77044952
2-[cyclopentyl(4-methoxybutyl)amino]-N'-hydroxyethanimidamide
CID 104647778
2-[cyclohexyl(methyl)amino]-N'-hydroxyethanimidamide
CID 24706703
3-[cyclobutylmethyl(cyclopropyl)amino]-N'-hydroxypropanimidamide
CID 77067845
2-[cyclopentyl-[(4-methylmorpholin-2-yl)methyl]amino]-N'-hydroxyethanimidamide
CID 79172237
N'-hydroxy-2-[methyl-(2-methylcyclohexyl)amino]ethanimidamide
CID 76912047
2-[cyclopentyl-[(4-propan-2-ylphenyl)methyl]amino]-N'-hydroxyethanimidamide
CID 77044796
2-[cyclopropyl(2,2,2-trifluoroethyl)amino]-N'-hydroxyethanimidamide
CID 76912585
5-[cyclohexyl(methyl)amino]-N'-hydroxypentanimidamide
CID 109374536
2-[(3,4-dimethylcyclohexyl)-methylamino]-N'-hydroxyethanimidamide
CID 77054342
2-[2-(dimethylamino)ethyl-(4-propan-2-ylcycloheptyl)amino]acetic acid
CID 107426098

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl-[2-(dimethylamino)ethyl]amino]-N'-hydroxyethanimidamide?
The IUPAC name of 2-[cyclopentyl-[2-(dimethylamino)ethyl]amino]-N'-hydroxyethanimidamide (CID 77037907) is 2-[cyclopentyl-[2-(dimethylamino)ethyl]amino]-N'-hydroxyethanimidamide.
What is the SMILES notation for 2-[cyclopentyl-[2-(dimethylamino)ethyl]amino]-N'-hydroxyethanimidamide?
The canonical SMILES for 2-[cyclopentyl-[2-(dimethylamino)ethyl]amino]-N'-hydroxyethanimidamide is CN(C)CCN(CC(N)=NO)C1CCCC1.
What is the InChIKey of 2-[cyclopentyl-[2-(dimethylamino)ethyl]amino]-N'-hydroxyethanimidamide?
The InChIKey is VOMXIUSJXPAYKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N4O/c1-14(2)7-8-15(9-11(12)13-16)10-5-3-4-6-10/h10,16H,3-9H2,1-2H3,(H2,12,13).
What are the key properties of 2-[cyclopentyl-[2-(dimethylamino)ethyl]amino]-N'-hydroxyethanimidamide?
2-[cyclopentyl-[2-(dimethylamino)ethyl]amino]-N'-hydroxyethanimidamide has a molecular weight of 228.34 g/mol, XLogP of 0.54, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentyl-[2-(dimethylamino)ethyl]amino]-N'-hydroxyethanimidamide is sourced from PubChem (CID 77037907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).