(4-methyl-2-naphthalen-1-ylcyclohexyl)methanamine

C18H23N — CID 81010085

IUPAC(4-methyl-2-naphthalen-1-ylcyclohexyl)methanamine
SMILESCC1CCC(CN)C(c2cccc3ccccc23)C1
InChIInChI=1S/C18H23N/c1-13-9-10-15(12-19)18(11-13)17-8-4-6-14-5-2-3-7-16(14)17/h2-8,13,15,18H,9-12,19H2,1H3
InChIKeyHQPKSNANOISZLJ-UHFFFAOYSA-N
MW253.39 g/mol
LogP4.32
Rot. Bonds2

About (4-methyl-2-naphthalen-1-ylcyclohexyl)methanamine

(4-methyl-2-naphthalen-1-ylcyclohexyl)methanamine (PubChem CID 81010085) has the molecular formula C18H23N and a molecular weight of 253.39 g/mol. Its IUPAC name is (4-methyl-2-naphthalen-1-ylcyclohexyl)methanamine.

Molecular Properties

Compound Name(4-methyl-2-naphthalen-1-ylcyclohexyl)methanamine
PubChem CID81010085
Molecular FormulaC18H23N
Molecular Weight253.39 g/mol
Exact Mass253.18
IUPAC Name(4-methyl-2-naphthalen-1-ylcyclohexyl)methanamine
SMILESCC1CCC(CN)C(c2cccc3ccccc23)C1
InChIInChI=1S/C18H23N/c1-13-9-10-15(12-19)18(11-13)17-8-4-6-14-5-2-3-7-16(14)17/h2-8,13,15,18H,9-12,19H2,1H3
InChIKeyHQPKSNANOISZLJ-UHFFFAOYSA-N
XLogP4.32
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (4-methyl-2-naphthalen-1-ylcyclohexyl)methanamine?
The IUPAC name of (4-methyl-2-naphthalen-1-ylcyclohexyl)methanamine (CID 81010085) is (4-methyl-2-naphthalen-1-ylcyclohexyl)methanamine.
What is the SMILES notation for (4-methyl-2-naphthalen-1-ylcyclohexyl)methanamine?
The canonical SMILES for (4-methyl-2-naphthalen-1-ylcyclohexyl)methanamine is CC1CCC(CN)C(c2cccc3ccccc23)C1.
What is the InChIKey of (4-methyl-2-naphthalen-1-ylcyclohexyl)methanamine?
The InChIKey is HQPKSNANOISZLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N/c1-13-9-10-15(12-19)18(11-13)17-8-4-6-14-5-2-3-7-16(14)17/h2-8,13,15,18H,9-12,19H2,1H3.
What are the key properties of (4-methyl-2-naphthalen-1-ylcyclohexyl)methanamine?
(4-methyl-2-naphthalen-1-ylcyclohexyl)methanamine has a molecular weight of 253.39 g/mol, XLogP of 4.32, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methyl-2-naphthalen-1-ylcyclohexyl)methanamine is sourced from PubChem (CID 81010085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).