N-(2-methoxyethoxy)cyclohexanamine

C9H19NO2 — CID 82712676

IUPACN-(2-methoxyethoxy)cyclohexanamine
SMILESCOCCONC1CCCCC1
InChIInChI=1S/C9H19NO2/c1-11-7-8-12-10-9-5-3-2-4-6-9/h9-10H,2-8H2,1H3
InChIKeyBEGRBUOEVDUUGB-UHFFFAOYSA-N
MW173.26 g/mol
LogP1.49
Rot. Bonds5

About N-(2-methoxyethoxy)cyclohexanamine

N-(2-methoxyethoxy)cyclohexanamine (PubChem CID 82712676) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is N-(2-methoxyethoxy)cyclohexanamine.

Molecular Properties

Compound NameN-(2-methoxyethoxy)cyclohexanamine
PubChem CID82712676
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC NameN-(2-methoxyethoxy)cyclohexanamine
SMILESCOCCONC1CCCCC1
InChIInChI=1S/C9H19NO2/c1-11-7-8-12-10-9-5-3-2-4-6-9/h9-10H,2-8H2,1H3
InChIKeyBEGRBUOEVDUUGB-UHFFFAOYSA-N
XLogP1.49
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(methoxymethoxy)cyclohexanamine
CID 87845817
N-(2-methoxyethoxy)-4-(trifluoromethyl)cyclohexan-1-amine
CID 82714410
N-(2-methoxyethoxy)oxetan-3-amine
CID 82711796
N-(2-methoxyethoxy)-2-methylcyclohexan-1-amine
CID 82710807
N-(2-methoxyethyl)cycloheptanamine
CID 22484521
N-methoxycyclohexanamine
CID 10975508
2-methoxyethoxycyclohexane
CID 20550469
tert-butyl N-[4-(2-methoxyethoxyamino)cyclohexyl]carbamate
CID 82715215
N-(2-methylpropoxy)cyclopentanamine
CID 82709938
N-(2-methoxyethoxy)cyclohexanecarboxamide
CID 79675541
N-cycloheptyl-3-methoxypropanamide
CID 110839127
N-(2-methoxyethoxy)-2,3-dimethylcyclohexan-1-amine
CID 82715306

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethoxy)cyclohexanamine?
The IUPAC name of N-(2-methoxyethoxy)cyclohexanamine (CID 82712676) is N-(2-methoxyethoxy)cyclohexanamine.
What is the SMILES notation for N-(2-methoxyethoxy)cyclohexanamine?
The canonical SMILES for N-(2-methoxyethoxy)cyclohexanamine is COCCONC1CCCCC1.
What is the InChIKey of N-(2-methoxyethoxy)cyclohexanamine?
The InChIKey is BEGRBUOEVDUUGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2/c1-11-7-8-12-10-9-5-3-2-4-6-9/h9-10H,2-8H2,1H3.
What are the key properties of N-(2-methoxyethoxy)cyclohexanamine?
N-(2-methoxyethoxy)cyclohexanamine has a molecular weight of 173.26 g/mol, XLogP of 1.49, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethoxy)cyclohexanamine is sourced from PubChem (CID 82712676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).