2-(aminomethyl)-N-cyclohexyl-5-methoxy-N-methylaniline

C15H24N2O — CID 81298046

IUPAC2-(aminomethyl)-N-cyclohexyl-5-methoxy-N-methylaniline
SMILESCOc1ccc(CN)c(N(C)C2CCCCC2)c1
InChIInChI=1S/C15H24N2O/c1-17(13-6-4-3-5-7-13)15-10-14(18-2)9-8-12(15)11-16/h8-10,13H,3-7,11,16H2,1-2H3
InChIKeySVLWKLCKYHQVGK-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.92
Rot. Bonds4

About 2-(aminomethyl)-N-cyclohexyl-5-methoxy-N-methylaniline

2-(aminomethyl)-N-cyclohexyl-5-methoxy-N-methylaniline (PubChem CID 81298046) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 2-(aminomethyl)-N-cyclohexyl-5-methoxy-N-methylaniline.

Molecular Properties

Compound Name2-(aminomethyl)-N-cyclohexyl-5-methoxy-N-methylaniline
PubChem CID81298046
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name2-(aminomethyl)-N-cyclohexyl-5-methoxy-N-methylaniline
SMILESCOc1ccc(CN)c(N(C)C2CCCCC2)c1
InChIInChI=1S/C15H24N2O/c1-17(13-6-4-3-5-7-13)15-10-14(18-2)9-8-12(15)11-16/h8-10,13H,3-7,11,16H2,1-2H3
InChIKeySVLWKLCKYHQVGK-UHFFFAOYSA-N
XLogP2.92
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(aminomethyl)-N-(4,4-dimethylcyclohexyl)-5-methoxy-N-methylaniline
CID 81299543
2-(aminomethyl)-5-methoxy-N-(4-methoxyphenyl)-N-methylaniline
CID 81299533
N-[2-(aminomethyl)-4-methylphenyl]-N-methylcycloheptanamine
CID 114016631
2-(aminomethyl)-5-methoxy-N-methyl-N-(oxolan-2-ylmethyl)aniline
CID 81298982
[2-(cyclopentylmethylsulfanyl)-4-methoxyphenyl]methanamine
CID 81305086
2-(aminomethyl)-N,5-dimethyl-N-(3-methylcyclohexyl)aniline
CID 62307780
2-(aminomethyl)-N-cyclopropyl-N-(furan-2-ylmethyl)-5-methoxyaniline
CID 81299175
N-[5-chloro-2-(chloromethyl)phenyl]-N-methylcycloheptanamine
CID 114846425
N'-cyclohexyl-1-(2,5-dimethoxyphenyl)-N'-methylethane-1,2-diamine
CID 16790532
2-(aminomethyl)-5-methoxy-N-methyl-N-(pyridin-4-ylmethyl)aniline
CID 81299898
(2-ethyl-4-methoxyphenyl)methanamine;hydrochloride
CID 146082087
N-[2-(2-aminobutyl)-5-chlorophenyl]-N-methylcycloheptanamine
CID 114860719

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-cyclohexyl-5-methoxy-N-methylaniline?
The IUPAC name of 2-(aminomethyl)-N-cyclohexyl-5-methoxy-N-methylaniline (CID 81298046) is 2-(aminomethyl)-N-cyclohexyl-5-methoxy-N-methylaniline.
What is the SMILES notation for 2-(aminomethyl)-N-cyclohexyl-5-methoxy-N-methylaniline?
The canonical SMILES for 2-(aminomethyl)-N-cyclohexyl-5-methoxy-N-methylaniline is COc1ccc(CN)c(N(C)C2CCCCC2)c1.
What is the InChIKey of 2-(aminomethyl)-N-cyclohexyl-5-methoxy-N-methylaniline?
The InChIKey is SVLWKLCKYHQVGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-17(13-6-4-3-5-7-13)15-10-14(18-2)9-8-12(15)11-16/h8-10,13H,3-7,11,16H2,1-2H3.
What are the key properties of 2-(aminomethyl)-N-cyclohexyl-5-methoxy-N-methylaniline?
2-(aminomethyl)-N-cyclohexyl-5-methoxy-N-methylaniline has a molecular weight of 248.37 g/mol, XLogP of 2.92, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-cyclohexyl-5-methoxy-N-methylaniline is sourced from PubChem (CID 81298046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).