2-cyclopropyl-1-(1-ethoxy-3-methylcyclohexyl)ethanamine

C14H27NO — CID 116767988

IUPAC2-cyclopropyl-1-(1-ethoxy-3-methylcyclohexyl)ethanamine
SMILESCCOC1(C(N)CC2CC2)CCCC(C)C1
InChIInChI=1S/C14H27NO/c1-3-16-14(8-4-5-11(2)10-14)13(15)9-12-6-7-12/h11-13H,3-10,15H2,1-2H3
InChIKeySHFLVDODNAPWDQ-UHFFFAOYSA-N
MW225.38 g/mol
LogP3.10
Rot. Bonds5

About 2-cyclopropyl-1-(1-ethoxy-3-methylcyclohexyl)ethanamine

2-cyclopropyl-1-(1-ethoxy-3-methylcyclohexyl)ethanamine (PubChem CID 116767988) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is 2-cyclopropyl-1-(1-ethoxy-3-methylcyclohexyl)ethanamine.

Molecular Properties

Compound Name2-cyclopropyl-1-(1-ethoxy-3-methylcyclohexyl)ethanamine
PubChem CID116767988
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC Name2-cyclopropyl-1-(1-ethoxy-3-methylcyclohexyl)ethanamine
SMILESCCOC1(C(N)CC2CC2)CCCC(C)C1
InChIInChI=1S/C14H27NO/c1-3-16-14(8-4-5-11(2)10-14)13(15)9-12-6-7-12/h11-13H,3-10,15H2,1-2H3
InChIKeySHFLVDODNAPWDQ-UHFFFAOYSA-N
XLogP3.10
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(1-ethoxy-3-methylcyclohexyl)-2-methoxyethanamine
CID 116768089
(1-ethoxy-3-methylcyclohexyl)-(4-methylcyclohexyl)methanamine
CID 116768084
cycloheptyl-(1-ethoxy-3-methylcyclohexyl)methanamine
CID 116768145
1-(1-ethoxy-3-methylcyclohexyl)-3-methylidenepentan-1-amine
CID 116768117
1-(1-ethoxy-3-methylcyclohexyl)-2-ethylbutan-1-amine
CID 116768094
2-cyclohexyl-1-(1-ethoxy-3-methylcyclohexyl)ethanol
CID 116755222
1-(1-ethoxy-3-methylcyclohexyl)-5-methoxypentan-1-amine
CID 112754280
1-(1-ethoxy-3-methylcyclohexyl)-2-phenylethanamine
CID 116768003
cyclopropyl-(1-ethoxy-3-methylcyclohexyl)methanol
CID 116755285
(1-ethoxy-3-methylcyclohexyl)-(oxolan-3-yl)methanamine
CID 116768060
2-(4-chlorophenyl)-1-(1-ethoxy-3-methylcyclohexyl)ethanamine
CID 116768047
1-(1-ethoxy-3-methylcyclohexyl)-2,2-dimethylpropan-1-ol
CID 116755351

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-(1-ethoxy-3-methylcyclohexyl)ethanamine?
The IUPAC name of 2-cyclopropyl-1-(1-ethoxy-3-methylcyclohexyl)ethanamine (CID 116767988) is 2-cyclopropyl-1-(1-ethoxy-3-methylcyclohexyl)ethanamine.
What is the SMILES notation for 2-cyclopropyl-1-(1-ethoxy-3-methylcyclohexyl)ethanamine?
The canonical SMILES for 2-cyclopropyl-1-(1-ethoxy-3-methylcyclohexyl)ethanamine is CCOC1(C(N)CC2CC2)CCCC(C)C1.
What is the InChIKey of 2-cyclopropyl-1-(1-ethoxy-3-methylcyclohexyl)ethanamine?
The InChIKey is SHFLVDODNAPWDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-3-16-14(8-4-5-11(2)10-14)13(15)9-12-6-7-12/h11-13H,3-10,15H2,1-2H3.
What are the key properties of 2-cyclopropyl-1-(1-ethoxy-3-methylcyclohexyl)ethanamine?
2-cyclopropyl-1-(1-ethoxy-3-methylcyclohexyl)ethanamine has a molecular weight of 225.38 g/mol, XLogP of 3.10, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-(1-ethoxy-3-methylcyclohexyl)ethanamine is sourced from PubChem (CID 116767988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).