N-(2-ethoxyethyl)-4-methylcyclohexan-1-amine

C11H23NO — CID 43387964

IUPACN-(2-ethoxyethyl)-4-methylcyclohexan-1-amine
SMILESCCOCCNC1CCC(C)CC1
InChIInChI=1S/C11H23NO/c1-3-13-9-8-12-11-6-4-10(2)5-7-11/h10-12H,3-9H2,1-2H3
InChIKeyCGXNICXSPIHZIE-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.19
Rot. Bonds5

About N-(2-ethoxyethyl)-4-methylcyclohexan-1-amine

N-(2-ethoxyethyl)-4-methylcyclohexan-1-amine (PubChem CID 43387964) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is N-(2-ethoxyethyl)-4-methylcyclohexan-1-amine.

Molecular Properties

Compound NameN-(2-ethoxyethyl)-4-methylcyclohexan-1-amine
PubChem CID43387964
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC NameN-(2-ethoxyethyl)-4-methylcyclohexan-1-amine
SMILESCCOCCNC1CCC(C)CC1
InChIInChI=1S/C11H23NO/c1-3-13-9-8-12-11-6-4-10(2)5-7-11/h10-12H,3-9H2,1-2H3
InChIKeyCGXNICXSPIHZIE-UHFFFAOYSA-N
XLogP2.19
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(2-heptoxyethyl)-4-methylcyclohexan-1-amine
CID 55195526
N',N'-bis(2-ethoxyethyl)-N-(4-methylcyclohexyl)ethane-1,2-diamine
CID 82943267
N'-(2-ethoxyethyl)-N'-ethyl-N-(4-methylcyclohexyl)ethane-1,2-diamine
CID 63691083
4-methyl-N-[2-(2-methylpropoxy)ethyl]cyclohexan-1-amine
CID 62567459
N-(2-ethoxyethyl)oxan-4-amine
CID 43608661
N-(2-ethoxyethyl)-4-(trifluoromethyl)cyclohexan-1-amine
CID 64753627
trans-(1R,3R)-N-(2-ethoxyethyl)-3-methylcyclohexan-1-amine
CID 93051534
N-[3-(2-ethoxyethoxy)propyl]cyclopropanamine
CID 62445452
N-(2-ethoxyethyl)-4-ethylcycloheptan-1-amine
CID 65084124
N-[2-(2-ethoxyethoxy)ethyl]oxan-4-amine
CID 63099695
N-(2-cyclobutyloxyethyl)-4-methylcyclohexan-1-amine
CID 62584943
4-methyl-N-(2-propan-2-yloxyethyl)cyclohexan-1-amine
CID 60690321

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyethyl)-4-methylcyclohexan-1-amine?
The IUPAC name of N-(2-ethoxyethyl)-4-methylcyclohexan-1-amine (CID 43387964) is N-(2-ethoxyethyl)-4-methylcyclohexan-1-amine.
What is the SMILES notation for N-(2-ethoxyethyl)-4-methylcyclohexan-1-amine?
The canonical SMILES for N-(2-ethoxyethyl)-4-methylcyclohexan-1-amine is CCOCCNC1CCC(C)CC1.
What is the InChIKey of N-(2-ethoxyethyl)-4-methylcyclohexan-1-amine?
The InChIKey is CGXNICXSPIHZIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-3-13-9-8-12-11-6-4-10(2)5-7-11/h10-12H,3-9H2,1-2H3.
What are the key properties of N-(2-ethoxyethyl)-4-methylcyclohexan-1-amine?
N-(2-ethoxyethyl)-4-methylcyclohexan-1-amine has a molecular weight of 185.31 g/mol, XLogP of 2.19, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyethyl)-4-methylcyclohexan-1-amine is sourced from PubChem (CID 43387964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).