N-ethyl-2-methyl-1-(4-methylcyclohexyl)pentan-1-amine

C15H31N — CID 104988154

IUPACN-ethyl-2-methyl-1-(4-methylcyclohexyl)pentan-1-amine
SMILESCCCC(C)C(NCC)C1CCC(C)CC1
InChIInChI=1S/C15H31N/c1-5-7-13(4)15(16-6-2)14-10-8-12(3)9-11-14/h12-16H,5-11H2,1-4H3
InChIKeyLHJOZKBOKLZTSA-UHFFFAOYSA-N
MW225.42 g/mol
LogP4.23
Rot. Bonds6

About N-ethyl-2-methyl-1-(4-methylcyclohexyl)pentan-1-amine

N-ethyl-2-methyl-1-(4-methylcyclohexyl)pentan-1-amine (PubChem CID 104988154) has the molecular formula C15H31N and a molecular weight of 225.42 g/mol. Its IUPAC name is N-ethyl-2-methyl-1-(4-methylcyclohexyl)pentan-1-amine.

Molecular Properties

Compound NameN-ethyl-2-methyl-1-(4-methylcyclohexyl)pentan-1-amine
PubChem CID104988154
Molecular FormulaC15H31N
Molecular Weight225.42 g/mol
Exact Mass225.25
IUPAC NameN-ethyl-2-methyl-1-(4-methylcyclohexyl)pentan-1-amine
SMILESCCCC(C)C(NCC)C1CCC(C)CC1
InChIInChI=1S/C15H31N/c1-5-7-13(4)15(16-6-2)14-10-8-12(3)9-11-14/h12-16H,5-11H2,1-4H3
InChIKeyLHJOZKBOKLZTSA-UHFFFAOYSA-N
XLogP4.23
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.42
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-ethyl-2-methoxy-1-(4-methylcyclohexyl)propan-1-amine
CID 79616589
1-(1,9-dioxaspiro[5.5]undecan-4-yl)-N-ethyl-2-methylpentan-1-amine
CID 105012146
N-ethyl-2-methyl-1-(3-methyloxolan-2-yl)pentan-1-amine
CID 107893426
N-ethyl-2-methyl-1-(2-methyloxolan-3-yl)pentan-1-amine
CID 107894019
N-ethyl-1-(4-ethylcyclohexyl)-2-methylbutan-1-amine
CID 64775258
N-ethyl-2-methyl-1-(3-methylsulfonylcyclohexyl)pentan-1-amine
CID 105014334
1-(3-ethylcyclopentyl)-2-methyl-N-propylpentan-1-amine
CID 114013790
(1-cyclopentyl-2-methylpentyl)hydrazine
CID 105282461
1-cyclooctyl-N,2-dimethylpentan-1-amine
CID 107893689
N-ethyl-4-methoxy-2-methyl-1-[4-(trifluoromethyl)cyclohexyl]butan-1-amine
CID 105185029
N-ethyl-2-methyl-1-[2-(trifluoromethyl)cyclohexyl]pentan-1-amine
CID 107893991
1-cyclohexyl-2-cyclopropyl-N-ethylpropan-1-amine
CID 114981084

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methyl-1-(4-methylcyclohexyl)pentan-1-amine?
The IUPAC name of N-ethyl-2-methyl-1-(4-methylcyclohexyl)pentan-1-amine (CID 104988154) is N-ethyl-2-methyl-1-(4-methylcyclohexyl)pentan-1-amine.
What is the SMILES notation for N-ethyl-2-methyl-1-(4-methylcyclohexyl)pentan-1-amine?
The canonical SMILES for N-ethyl-2-methyl-1-(4-methylcyclohexyl)pentan-1-amine is CCCC(C)C(NCC)C1CCC(C)CC1.
What is the InChIKey of N-ethyl-2-methyl-1-(4-methylcyclohexyl)pentan-1-amine?
The InChIKey is LHJOZKBOKLZTSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N/c1-5-7-13(4)15(16-6-2)14-10-8-12(3)9-11-14/h12-16H,5-11H2,1-4H3.
What are the key properties of N-ethyl-2-methyl-1-(4-methylcyclohexyl)pentan-1-amine?
N-ethyl-2-methyl-1-(4-methylcyclohexyl)pentan-1-amine has a molecular weight of 225.42 g/mol, XLogP of 4.23, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methyl-1-(4-methylcyclohexyl)pentan-1-amine is sourced from PubChem (CID 104988154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).