[1-(naphthalen-1-ylmethyl)cycloheptyl]methanamine

C19H25N — CID 65391703

IUPAC[1-(naphthalen-1-ylmethyl)cycloheptyl]methanamine
SMILESNCC1(Cc2cccc3ccccc23)CCCCCC1
InChIInChI=1S/C19H25N/c20-15-19(12-5-1-2-6-13-19)14-17-10-7-9-16-8-3-4-11-18(16)17/h3-4,7-11H,1-2,5-6,12-15,20H2
InChIKeyKYVWZWYDVHBBFG-UHFFFAOYSA-N
MW267.42 g/mol
LogP4.68
Rot. Bonds3

About [1-(naphthalen-1-ylmethyl)cycloheptyl]methanamine

[1-(naphthalen-1-ylmethyl)cycloheptyl]methanamine (PubChem CID 65391703) has the molecular formula C19H25N and a molecular weight of 267.42 g/mol. Its IUPAC name is [1-(naphthalen-1-ylmethyl)cycloheptyl]methanamine.

Molecular Properties

Compound Name[1-(naphthalen-1-ylmethyl)cycloheptyl]methanamine
PubChem CID65391703
Molecular FormulaC19H25N
Molecular Weight267.42 g/mol
Exact Mass267.20
IUPAC Name[1-(naphthalen-1-ylmethyl)cycloheptyl]methanamine
SMILESNCC1(Cc2cccc3ccccc23)CCCCCC1
InChIInChI=1S/C19H25N/c20-15-19(12-5-1-2-6-13-19)14-17-10-7-9-16-8-3-4-11-18(16)17/h3-4,7-11H,1-2,5-6,12-15,20H2
InChIKeyKYVWZWYDVHBBFG-UHFFFAOYSA-N
XLogP4.68
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 54.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of [1-(naphthalen-1-ylmethyl)cycloheptyl]methanamine?
The IUPAC name of [1-(naphthalen-1-ylmethyl)cycloheptyl]methanamine (CID 65391703) is [1-(naphthalen-1-ylmethyl)cycloheptyl]methanamine.
What is the SMILES notation for [1-(naphthalen-1-ylmethyl)cycloheptyl]methanamine?
The canonical SMILES for [1-(naphthalen-1-ylmethyl)cycloheptyl]methanamine is NCC1(Cc2cccc3ccccc23)CCCCCC1.
What is the InChIKey of [1-(naphthalen-1-ylmethyl)cycloheptyl]methanamine?
The InChIKey is KYVWZWYDVHBBFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N/c20-15-19(12-5-1-2-6-13-19)14-17-10-7-9-16-8-3-4-11-18(16)17/h3-4,7-11H,1-2,5-6,12-15,20H2.
What are the key properties of [1-(naphthalen-1-ylmethyl)cycloheptyl]methanamine?
[1-(naphthalen-1-ylmethyl)cycloheptyl]methanamine has a molecular weight of 267.42 g/mol, XLogP of 4.68, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(naphthalen-1-ylmethyl)cycloheptyl]methanamine is sourced from PubChem (CID 65391703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).