N-[1-(4-methoxyphenyl)ethyl]cyclohexanamine

C15H23NO — CID 43189950

IUPACN-[1-(4-methoxyphenyl)ethyl]cyclohexanamine
SMILESCOc1ccc(C(C)NC2CCCCC2)cc1
InChIInChI=1S/C15H23NO/c1-12(16-14-6-4-3-5-7-14)13-8-10-15(17-2)11-9-13/h8-12,14,16H,3-7H2,1-2H3
InChIKeyVJLZKVSDNDBKMS-UHFFFAOYSA-N
MW233.36 g/mol
LogP3.68
Rot. Bonds4

About N-[1-(4-methoxyphenyl)ethyl]cyclohexanamine

N-[1-(4-methoxyphenyl)ethyl]cyclohexanamine (PubChem CID 43189950) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is N-[1-(4-methoxyphenyl)ethyl]cyclohexanamine.

Molecular Properties

Compound NameN-[1-(4-methoxyphenyl)ethyl]cyclohexanamine
PubChem CID43189950
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC NameN-[1-(4-methoxyphenyl)ethyl]cyclohexanamine
SMILESCOc1ccc(C(C)NC2CCCCC2)cc1
InChIInChI=1S/C15H23NO/c1-12(16-14-6-4-3-5-7-14)13-8-10-15(17-2)11-9-13/h8-12,14,16H,3-7H2,1-2H3
InChIKeyVJLZKVSDNDBKMS-UHFFFAOYSA-N
XLogP3.68
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1R)-1-(4-methoxyphenyl)ethyl]-4-methylcycloheptan-1-amine
CID 81370708
4-N-[1-(4-methoxyphenyl)ethyl]cyclohexane-1,4-diamine
CID 55062721
N-[(1R)-1-(4-methoxyphenyl)ethyl]thian-4-amine
CID 81370902
N-[(1S)-1-(4-methoxyphenyl)ethyl]piperidin-3-amine
CID 81370566
(1S)-N-(cyclohexylmethyl)-1-(4-methoxyphenyl)ethanamine
CID 81371290
3-ethyl-N-[(1R)-1-(4-methoxyphenyl)ethyl]cyclohexan-1-amine
CID 81371165
N-[(1R)-1-(4-methoxyphenyl)ethyl]-3-methylcyclobutan-1-amine
CID 103562144
N-[1-(4-methoxyphenyl)ethyl]azetidin-3-amine
CID 66244684
N-[(1R)-1-(4-methoxyphenyl)ethyl]-3-(2-methylpropyl)cyclohexan-1-amine
CID 107428628
2-[[(1R)-1-(4-methoxyphenyl)ethyl]amino]cyclohexan-1-ol
CID 81371394
N-[1-[4-(trifluoromethoxy)phenyl]ethyl]cyclopentanamine
CID 43190434
3-[1-(4-methoxyphenyl)ethylamino]cyclohexane-1-carboxylic acid
CID 65066346

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-methoxyphenyl)ethyl]cyclohexanamine?
The IUPAC name of N-[1-(4-methoxyphenyl)ethyl]cyclohexanamine (CID 43189950) is N-[1-(4-methoxyphenyl)ethyl]cyclohexanamine.
What is the SMILES notation for N-[1-(4-methoxyphenyl)ethyl]cyclohexanamine?
The canonical SMILES for N-[1-(4-methoxyphenyl)ethyl]cyclohexanamine is COc1ccc(C(C)NC2CCCCC2)cc1.
What is the InChIKey of N-[1-(4-methoxyphenyl)ethyl]cyclohexanamine?
The InChIKey is VJLZKVSDNDBKMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-12(16-14-6-4-3-5-7-14)13-8-10-15(17-2)11-9-13/h8-12,14,16H,3-7H2,1-2H3.
What are the key properties of N-[1-(4-methoxyphenyl)ethyl]cyclohexanamine?
N-[1-(4-methoxyphenyl)ethyl]cyclohexanamine has a molecular weight of 233.36 g/mol, XLogP of 3.68, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-methoxyphenyl)ethyl]cyclohexanamine is sourced from PubChem (CID 43189950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).