3-(2-methylcyclohexyl)oxypropanimidamide

C10H20N2O — CID 24704850

IUPAC3-(2-methylcyclohexyl)oxypropanimidamide
SMILES[H]/N=C(\N)CCOC1CCCCC1C
InChIInChI=1S/C10H20N2O/c1-8-4-2-3-5-9(8)13-7-6-10(11)12/h8-9H,2-7H2,1H3,(H3,11,12)
InChIKeyGALOLOMMTSYKTN-UHFFFAOYSA-N
MW184.28 g/mol
LogP1.91
Rot. Bonds4

About 3-(2-methylcyclohexyl)oxypropanimidamide

3-(2-methylcyclohexyl)oxypropanimidamide (PubChem CID 24704850) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 3-(2-methylcyclohexyl)oxypropanimidamide.

Molecular Properties

Compound Name3-(2-methylcyclohexyl)oxypropanimidamide
PubChem CID24704850
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name3-(2-methylcyclohexyl)oxypropanimidamide
SMILES[H]/N=C(\N)CCOC1CCCCC1C
InChIInChI=1S/C10H20N2O/c1-8-4-2-3-5-9(8)13-7-6-10(11)12/h8-9H,2-7H2,1H3,(H3,11,12)
InChIKeyGALOLOMMTSYKTN-UHFFFAOYSA-N
XLogP1.91
TPSA59.10 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

2-[(2-Ethylcyclohexyl)oxymethyl]-3,3,3-trifluoropropanimidamide
CID 103370926
2-(Cyclohexylmethoxymethyl)-3,3,3-trifluoropropanimidamide
CID 103371042
3,3,3-Trifluoro-2-[(2-methylcyclohexyl)oxymethyl]propanimidamide
CID 113808198
3,3,3-Trifluoro-2-[(4-methylcyclohexyl)oxymethyl]propanimidamide
CID 113808199
3,3,3-Trifluoro-2-[(3-methylcyclohexyl)oxymethyl]propanimidamide
CID 113808208
2-[(3-Ethylcyclohexyl)oxymethyl]-3,3,3-trifluoropropanimidamide
CID 113808218
4-(4-Ethylheptoxy)cyclohexane-1-carboximidamide
CID 89242726
N'-hydroxy-3-(4-methylcyclohexyl)oxypropanimidamide
CID 24691798
4-(2-Methylcyclohexyl)oxybutanimidamide
CID 24691958
4-(4-Methylcyclohexyl)oxybutanimidamide
CID 24693381
N'-hydroxy-3-(2-methylcyclohexyl)oxypropanimidamide
CID 24693790
3-(2-Ethylcyclohexyl)oxypropanimidamide
CID 24694801

Frequently Asked Questions

What is the IUPAC name of 3-(2-methylcyclohexyl)oxypropanimidamide?
The IUPAC name of 3-(2-methylcyclohexyl)oxypropanimidamide (CID 24704850) is 3-(2-methylcyclohexyl)oxypropanimidamide.
What is the SMILES notation for 3-(2-methylcyclohexyl)oxypropanimidamide?
The canonical SMILES for 3-(2-methylcyclohexyl)oxypropanimidamide is [H]/N=C(\N)CCOC1CCCCC1C.
What is the InChIKey of 3-(2-methylcyclohexyl)oxypropanimidamide?
The InChIKey is GALOLOMMTSYKTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-8-4-2-3-5-9(8)13-7-6-10(11)12/h8-9H,2-7H2,1H3,(H3,11,12).
What are the key properties of 3-(2-methylcyclohexyl)oxypropanimidamide?
3-(2-methylcyclohexyl)oxypropanimidamide has a molecular weight of 184.28 g/mol, XLogP of 1.91, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylcyclohexyl)oxypropanimidamide is sourced from PubChem (CID 24704850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).