2-methyl-N-[2-[2-(2-methylpropoxy)ethoxy]ethyl]cyclohexan-1-amine

C15H31NO2 — CID 106450291

IUPAC2-methyl-N-[2-[2-(2-methylpropoxy)ethoxy]ethyl]cyclohexan-1-amine
SMILESCC(C)COCCOCCNC1CCCCC1C
InChIInChI=1S/C15H31NO2/c1-13(2)12-18-11-10-17-9-8-16-15-7-5-4-6-14(15)3/h13-16H,4-12H2,1-3H3
InChIKeyWGPGOXZUJUHLIK-UHFFFAOYSA-N
MW257.42 g/mol
LogP2.84
Rot. Bonds9

About 2-methyl-N-[2-[2-(2-methylpropoxy)ethoxy]ethyl]cyclohexan-1-amine

2-methyl-N-[2-[2-(2-methylpropoxy)ethoxy]ethyl]cyclohexan-1-amine (PubChem CID 106450291) has the molecular formula C15H31NO2 and a molecular weight of 257.42 g/mol. Its IUPAC name is 2-methyl-N-[2-[2-(2-methylpropoxy)ethoxy]ethyl]cyclohexan-1-amine.

Molecular Properties

Compound Name2-methyl-N-[2-[2-(2-methylpropoxy)ethoxy]ethyl]cyclohexan-1-amine
PubChem CID106450291
Molecular FormulaC15H31NO2
Molecular Weight257.42 g/mol
Exact Mass257.24
IUPAC Name2-methyl-N-[2-[2-(2-methylpropoxy)ethoxy]ethyl]cyclohexan-1-amine
SMILESCC(C)COCCOCCNC1CCCCC1C
InChIInChI=1S/C15H31NO2/c1-13(2)12-18-11-10-17-9-8-16-15-7-5-4-6-14(15)3/h13-16H,4-12H2,1-3H3
InChIKeyWGPGOXZUJUHLIK-UHFFFAOYSA-N
XLogP2.84
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.42
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-2-methylcycloheptan-1-amine
CID 104562465
trans-(1R,2R)-2-[2-(2-methylpropoxy)ethylamino]cyclohexan-1-ol
CID 102731750
N-(2-ethoxyethyl)-2-methylcyclopentan-1-amine
CID 63278014
2-methyl-N-[1-(2-methylpropoxy)propan-2-yl]cyclohexan-1-amine
CID 115889323
2-methyl-N-[2-(2-methylpropoxy)ethyl]thiolan-3-amine
CID 102671626
2-methyl-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]cycloheptan-1-amine
CID 112589213
2-methyl-N-(3-propan-2-yloxypropyl)cyclohexan-1-amine
CID 43183143
2-methyl-N-(3-methylbutyl)cyclopentan-1-amine
CID 63277629
4-methyl-N-[2-(2-methylpropoxy)ethyl]cyclohexan-1-amine
CID 62567459
N-[2-(2-methoxyethoxy)ethyl]-2-propan-2-ylcyclohexan-1-amine
CID 81328492
tert-butyl N-[[2-[2-(2-methylpropoxy)ethylamino]cyclopentyl]methyl]carbamate
CID 103947742
N-[3-(2-methylpropoxy)propyl]cyclopentanamine
CID 28681533

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[2-[2-(2-methylpropoxy)ethoxy]ethyl]cyclohexan-1-amine?
The IUPAC name of 2-methyl-N-[2-[2-(2-methylpropoxy)ethoxy]ethyl]cyclohexan-1-amine (CID 106450291) is 2-methyl-N-[2-[2-(2-methylpropoxy)ethoxy]ethyl]cyclohexan-1-amine.
What is the SMILES notation for 2-methyl-N-[2-[2-(2-methylpropoxy)ethoxy]ethyl]cyclohexan-1-amine?
The canonical SMILES for 2-methyl-N-[2-[2-(2-methylpropoxy)ethoxy]ethyl]cyclohexan-1-amine is CC(C)COCCOCCNC1CCCCC1C.
What is the InChIKey of 2-methyl-N-[2-[2-(2-methylpropoxy)ethoxy]ethyl]cyclohexan-1-amine?
The InChIKey is WGPGOXZUJUHLIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31NO2/c1-13(2)12-18-11-10-17-9-8-16-15-7-5-4-6-14(15)3/h13-16H,4-12H2,1-3H3.
What are the key properties of 2-methyl-N-[2-[2-(2-methylpropoxy)ethoxy]ethyl]cyclohexan-1-amine?
2-methyl-N-[2-[2-(2-methylpropoxy)ethoxy]ethyl]cyclohexan-1-amine has a molecular weight of 257.42 g/mol, XLogP of 2.84, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-[2-(2-methylpropoxy)ethoxy]ethyl]cyclohexan-1-amine is sourced from PubChem (CID 106450291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).