N-[cycloheptyl-(4-ethylcyclohexyl)methyl]ethanamine

C18H35N — CID 65399653

IUPACN-[cycloheptyl-(4-ethylcyclohexyl)methyl]ethanamine
SMILESCCNC(C1CCCCCC1)C1CCC(CC)CC1
InChIInChI=1S/C18H35N/c1-3-15-11-13-17(14-12-15)18(19-4-2)16-9-7-5-6-8-10-16/h15-19H,3-14H2,1-2H3
InChIKeyYKHFIFNZVMUJCT-UHFFFAOYSA-N
MW265.48 g/mol
LogP5.15
Rot. Bonds5

About N-[cycloheptyl-(4-ethylcyclohexyl)methyl]ethanamine

N-[cycloheptyl-(4-ethylcyclohexyl)methyl]ethanamine (PubChem CID 65399653) has the molecular formula C18H35N and a molecular weight of 265.48 g/mol. Its IUPAC name is N-[cycloheptyl-(4-ethylcyclohexyl)methyl]ethanamine.

Molecular Properties

Compound NameN-[cycloheptyl-(4-ethylcyclohexyl)methyl]ethanamine
PubChem CID65399653
Molecular FormulaC18H35N
Molecular Weight265.48 g/mol
Exact Mass265.28
IUPAC NameN-[cycloheptyl-(4-ethylcyclohexyl)methyl]ethanamine
SMILESCCNC(C1CCCCCC1)C1CCC(CC)CC1
InChIInChI=1S/C18H35N/c1-3-15-11-13-17(14-12-15)18(19-4-2)16-9-7-5-6-8-10-16/h15-19H,3-14H2,1-2H3
InChIKeyYKHFIFNZVMUJCT-UHFFFAOYSA-N
XLogP5.15
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500265.48
LogP ≤ 55.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[cyclobutyl-(4-ethylcyclohexyl)methyl]propan-1-amine
CID 64986298
1-ethyl-4-propan-2-ylcyclohexane;propan-2-ylcycloheptane;propan-2-ylcyclopentane
CID 159304571
N-[3-bicyclo[3.1.0]hexanyl(cyclohexyl)methyl]ethanamine
CID 114981006
N-[cycloheptyl-[4-(trifluoromethyl)cyclohexyl]methyl]ethanamine
CID 105176328
N-[(2,2-dimethylcyclopentyl)-(4-ethylcyclohexyl)methyl]ethanamine
CID 107189244
cyclohexyl-(4-ethylcyclohexyl)methanol
CID 64749927
cyclooctyl-(4-ethylcyclohexyl)methanol
CID 80602985
N-[cyclohexyl-(2-methylcyclopropyl)methyl]ethanamine
CID 65420198
N-ethyl-1-(4-ethylcycloheptyl)-2-methylpropan-1-amine
CID 79298525
1-cyclohexyl-2-cyclopropyl-N-ethylpropan-1-amine
CID 114981084
N-ethyl-1-(4-ethylcyclohexyl)-2-methylbutan-1-amine
CID 64775258
N-[cyclopentyl-(3-methylcyclohexyl)methyl]ethanamine
CID 63415340

Frequently Asked Questions

What is the IUPAC name of N-[cycloheptyl-(4-ethylcyclohexyl)methyl]ethanamine?
The IUPAC name of N-[cycloheptyl-(4-ethylcyclohexyl)methyl]ethanamine (CID 65399653) is N-[cycloheptyl-(4-ethylcyclohexyl)methyl]ethanamine.
What is the SMILES notation for N-[cycloheptyl-(4-ethylcyclohexyl)methyl]ethanamine?
The canonical SMILES for N-[cycloheptyl-(4-ethylcyclohexyl)methyl]ethanamine is CCNC(C1CCCCCC1)C1CCC(CC)CC1.
What is the InChIKey of N-[cycloheptyl-(4-ethylcyclohexyl)methyl]ethanamine?
The InChIKey is YKHFIFNZVMUJCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35N/c1-3-15-11-13-17(14-12-15)18(19-4-2)16-9-7-5-6-8-10-16/h15-19H,3-14H2,1-2H3.
What are the key properties of N-[cycloheptyl-(4-ethylcyclohexyl)methyl]ethanamine?
N-[cycloheptyl-(4-ethylcyclohexyl)methyl]ethanamine has a molecular weight of 265.48 g/mol, XLogP of 5.15, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[cycloheptyl-(4-ethylcyclohexyl)methyl]ethanamine is sourced from PubChem (CID 65399653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).