1-cyclohexyl-N-[(2-methoxynaphthalen-1-yl)methyl]methanamine

C19H25NO — CID 43215559

IUPAC1-cyclohexyl-N-[(2-methoxynaphthalen-1-yl)methyl]methanamine
SMILESCOc1ccc2ccccc2c1CNCC1CCCCC1
InChIInChI=1S/C19H25NO/c1-21-19-12-11-16-9-5-6-10-17(16)18(19)14-20-13-15-7-3-2-4-8-15/h5-6,9-12,15,20H,2-4,7-8,13-14H2,1H3
InChIKeyPUEIOJAPERWQOI-UHFFFAOYSA-N
MW283.42 g/mol
LogP4.52
Rot. Bonds5

About 1-cyclohexyl-N-[(2-methoxynaphthalen-1-yl)methyl]methanamine

1-cyclohexyl-N-[(2-methoxynaphthalen-1-yl)methyl]methanamine (PubChem CID 43215559) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is 1-cyclohexyl-N-[(2-methoxynaphthalen-1-yl)methyl]methanamine.

Molecular Properties

Compound Name1-cyclohexyl-N-[(2-methoxynaphthalen-1-yl)methyl]methanamine
PubChem CID43215559
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC Name1-cyclohexyl-N-[(2-methoxynaphthalen-1-yl)methyl]methanamine
SMILESCOc1ccc2ccccc2c1CNCC1CCCCC1
InChIInChI=1S/C19H25NO/c1-21-19-12-11-16-9-5-6-10-17(16)18(19)14-20-13-15-7-3-2-4-8-15/h5-6,9-12,15,20H,2-4,7-8,13-14H2,1H3
InChIKeyPUEIOJAPERWQOI-UHFFFAOYSA-N
XLogP4.52
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N-[(2-methoxynaphthalen-1-yl)methyl]methanamine?
The IUPAC name of 1-cyclohexyl-N-[(2-methoxynaphthalen-1-yl)methyl]methanamine (CID 43215559) is 1-cyclohexyl-N-[(2-methoxynaphthalen-1-yl)methyl]methanamine.
What is the SMILES notation for 1-cyclohexyl-N-[(2-methoxynaphthalen-1-yl)methyl]methanamine?
The canonical SMILES for 1-cyclohexyl-N-[(2-methoxynaphthalen-1-yl)methyl]methanamine is COc1ccc2ccccc2c1CNCC1CCCCC1.
What is the InChIKey of 1-cyclohexyl-N-[(2-methoxynaphthalen-1-yl)methyl]methanamine?
The InChIKey is PUEIOJAPERWQOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-21-19-12-11-16-9-5-6-10-17(16)18(19)14-20-13-15-7-3-2-4-8-15/h5-6,9-12,15,20H,2-4,7-8,13-14H2,1H3.
What are the key properties of 1-cyclohexyl-N-[(2-methoxynaphthalen-1-yl)methyl]methanamine?
1-cyclohexyl-N-[(2-methoxynaphthalen-1-yl)methyl]methanamine has a molecular weight of 283.42 g/mol, XLogP of 4.52, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-[(2-methoxynaphthalen-1-yl)methyl]methanamine is sourced from PubChem (CID 43215559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).