N-(4-ethylcyclohexyl)-2-(2-methoxyethyl)aniline

C17H27NO — CID 102903852

IUPACN-(4-ethylcyclohexyl)-2-(2-methoxyethyl)aniline
SMILESCCC1CCC(Nc2ccccc2CCOC)CC1
InChIInChI=1S/C17H27NO/c1-3-14-8-10-16(11-9-14)18-17-7-5-4-6-15(17)12-13-19-2/h4-7,14,16,18H,3,8-13H2,1-2H3
InChIKeyOKCNTYOHQJZJQY-UHFFFAOYSA-N
MW261.41 g/mol
LogP4.26
Rot. Bonds6

About N-(4-ethylcyclohexyl)-2-(2-methoxyethyl)aniline

N-(4-ethylcyclohexyl)-2-(2-methoxyethyl)aniline (PubChem CID 102903852) has the molecular formula C17H27NO and a molecular weight of 261.41 g/mol. Its IUPAC name is N-(4-ethylcyclohexyl)-2-(2-methoxyethyl)aniline.

Molecular Properties

Compound NameN-(4-ethylcyclohexyl)-2-(2-methoxyethyl)aniline
PubChem CID102903852
Molecular FormulaC17H27NO
Molecular Weight261.41 g/mol
Exact Mass261.21
IUPAC NameN-(4-ethylcyclohexyl)-2-(2-methoxyethyl)aniline
SMILESCCC1CCC(Nc2ccccc2CCOC)CC1
InChIInChI=1S/C17H27NO/c1-3-14-8-10-16(11-9-14)18-17-7-5-4-6-15(17)12-13-19-2/h4-7,14,16,18H,3,8-13H2,1-2H3
InChIKeyOKCNTYOHQJZJQY-UHFFFAOYSA-N
XLogP4.26
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.41
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclobutyl-2-(2-methoxyethyl)aniline
CID 102848928
N-(3,4-dimethylcyclohexyl)-2-(2-methoxyethyl)aniline
CID 102903864
N-[2-(2-methoxyethyl)phenyl]oxepan-4-amine
CID 102849048
1-N-[2-(2-methoxyethyl)phenyl]cyclohexane-1,3-diamine
CID 102903718
N-(2-cyclopropylethyl)-2-(2-methoxyethyl)aniline
CID 102847355
2-[2-(2-methoxyethyl)anilino]cyclopentan-1-ol
CID 102905089
2-(2-methoxyethyl)-N-[3-(trifluoromethyl)cyclohexyl]aniline
CID 102848912
N-[2-(methoxymethyl)phenyl]-4-propylcycloheptan-1-amine
CID 65086704
2-(2-aminoethyl)-N-cyclopropylaniline
CID 83816645
2-[(4-ethylcyclohexyl)amino]-N-methylbenzenesulfonamide
CID 43749872
5-chloro-N-[2-(2-methoxyethyl)phenyl]-2,3-dihydro-1H-inden-2-amine
CID 102848942
2-(2-methoxyethyl)-N-[2-(trifluoromethyl)cyclohexyl]aniline
CID 102903890

Frequently Asked Questions

What is the IUPAC name of N-(4-ethylcyclohexyl)-2-(2-methoxyethyl)aniline?
The IUPAC name of N-(4-ethylcyclohexyl)-2-(2-methoxyethyl)aniline (CID 102903852) is N-(4-ethylcyclohexyl)-2-(2-methoxyethyl)aniline.
What is the SMILES notation for N-(4-ethylcyclohexyl)-2-(2-methoxyethyl)aniline?
The canonical SMILES for N-(4-ethylcyclohexyl)-2-(2-methoxyethyl)aniline is CCC1CCC(Nc2ccccc2CCOC)CC1.
What is the InChIKey of N-(4-ethylcyclohexyl)-2-(2-methoxyethyl)aniline?
The InChIKey is OKCNTYOHQJZJQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27NO/c1-3-14-8-10-16(11-9-14)18-17-7-5-4-6-15(17)12-13-19-2/h4-7,14,16,18H,3,8-13H2,1-2H3.
What are the key properties of N-(4-ethylcyclohexyl)-2-(2-methoxyethyl)aniline?
N-(4-ethylcyclohexyl)-2-(2-methoxyethyl)aniline has a molecular weight of 261.41 g/mol, XLogP of 4.26, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylcyclohexyl)-2-(2-methoxyethyl)aniline is sourced from PubChem (CID 102903852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).