5-[cyclopropyl(ethyl)amino]-N'-hydroxypentanimidamide

C10H21N3O — CID 109374552

IUPAC5-[cyclopropyl(ethyl)amino]-N'-hydroxypentanimidamide
SMILESCCN(CCCC/C(N)=N/O)C1CC1
InChIInChI=1S/C10H21N3O/c1-2-13(9-6-7-9)8-4-3-5-10(11)12-14/h9,14H,2-8H2,1H3,(H2,11,12)
InChIKeyTYXIDBARFGJJKF-UHFFFAOYSA-N
MW199.30 g/mol
LogP1.39
Rot. Bonds7

About 5-[cyclopropyl(ethyl)amino]-N'-hydroxypentanimidamide

5-[cyclopropyl(ethyl)amino]-N'-hydroxypentanimidamide (PubChem CID 109374552) has the molecular formula C10H21N3O and a molecular weight of 199.30 g/mol. Its IUPAC name is 5-[cyclopropyl(ethyl)amino]-N'-hydroxypentanimidamide.

Molecular Properties

Compound Name5-[cyclopropyl(ethyl)amino]-N'-hydroxypentanimidamide
PubChem CID109374552
Molecular FormulaC10H21N3O
Molecular Weight199.30 g/mol
Exact Mass199.17
IUPAC Name5-[cyclopropyl(ethyl)amino]-N'-hydroxypentanimidamide
SMILESCCN(CCCC/C(N)=N/O)C1CC1
InChIInChI=1S/C10H21N3O/c1-2-13(9-6-7-9)8-4-3-5-10(11)12-14/h9,14H,2-8H2,1H3,(H2,11,12)
InChIKeyTYXIDBARFGJJKF-UHFFFAOYSA-N
XLogP1.39
TPSA61.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.30
LogP ≤ 51.39
H-Bond Donors ≤ 52
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'}

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Related Compounds

N'-hydroxy-5-[methyl-(4-methylcyclohexyl)amino]pentanimidamide
CID 94230169
4-[cyclobutyl(2-hydroxyethyl)amino]-N'-hydroxybutanimidamide
CID 102862968
5-[cyclohexyl(methyl)amino]-N'-hydroxypentanimidamide
CID 109374536
2-[cyclopentyl(hexyl)amino]-N'-hydroxyethanimidamide
CID 77044952
4-[(4-ethylcyclohexyl)-methylamino]-N'-hydroxybutanimidamide
CID 54948412
5-[ethyl(methyl)amino]-N'-hydroxypentanimidamide
CID 109374551
5-[cyclopropyl(thiophen-3-ylmethyl)amino]-N'-hydroxypentanimidamide
CID 54965704
N'-hydroxy-5-[methyl-(2-methylcyclohexyl)amino]pentanimidamide
CID 55005421
2-[cyclopentyl(4-methoxybutyl)amino]-N'-hydroxyethanimidamide
CID 104647778
5-[(1,1-dioxothiolan-3-yl)-methylamino]-N'-hydroxypentanimidamide
CID 54966234
ethyl 6-[(4-aminocyclohexyl)-ethylamino]hexanoate
CID 79116311
3-[(4-aminocyclohexyl)-ethylamino]propan-1-ol
CID 79115547

Frequently Asked Questions

What is the IUPAC name of 5-[cyclopropyl(ethyl)amino]-N'-hydroxypentanimidamide?
The IUPAC name of 5-[cyclopropyl(ethyl)amino]-N'-hydroxypentanimidamide (CID 109374552) is 5-[cyclopropyl(ethyl)amino]-N'-hydroxypentanimidamide.
What is the SMILES notation for 5-[cyclopropyl(ethyl)amino]-N'-hydroxypentanimidamide?
The canonical SMILES for 5-[cyclopropyl(ethyl)amino]-N'-hydroxypentanimidamide is CCN(CCCC/C(N)=N/O)C1CC1.
What is the InChIKey of 5-[cyclopropyl(ethyl)amino]-N'-hydroxypentanimidamide?
The InChIKey is TYXIDBARFGJJKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O/c1-2-13(9-6-7-9)8-4-3-5-10(11)12-14/h9,14H,2-8H2,1H3,(H2,11,12).
What are the key properties of 5-[cyclopropyl(ethyl)amino]-N'-hydroxypentanimidamide?
5-[cyclopropyl(ethyl)amino]-N'-hydroxypentanimidamide has a molecular weight of 199.30 g/mol, XLogP of 1.39, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[cyclopropyl(ethyl)amino]-N'-hydroxypentanimidamide is sourced from PubChem (CID 109374552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).