2-[2-(cyclopropylmethoxy)naphthalen-1-yl]ethanamine

C16H19NO — CID 54930636

IUPAC2-[2-(cyclopropylmethoxy)naphthalen-1-yl]ethanamine
SMILESNCCc1c(OCC2CC2)ccc2ccccc12
InChIInChI=1S/C16H19NO/c17-10-9-15-14-4-2-1-3-13(14)7-8-16(15)18-11-12-5-6-12/h1-4,7-8,12H,5-6,9-11,17H2
InChIKeySLIJZRKPEXBBLR-UHFFFAOYSA-N
MW241.33 g/mol
LogP3.13
Rot. Bonds5

About 2-[2-(cyclopropylmethoxy)naphthalen-1-yl]ethanamine

2-[2-(cyclopropylmethoxy)naphthalen-1-yl]ethanamine (PubChem CID 54930636) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is 2-[2-(cyclopropylmethoxy)naphthalen-1-yl]ethanamine.

Molecular Properties

Compound Name2-[2-(cyclopropylmethoxy)naphthalen-1-yl]ethanamine
PubChem CID54930636
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC Name2-[2-(cyclopropylmethoxy)naphthalen-1-yl]ethanamine
SMILESNCCc1c(OCC2CC2)ccc2ccccc12
InChIInChI=1S/C16H19NO/c17-10-9-15-14-4-2-1-3-13(14)7-8-16(15)18-11-12-5-6-12/h1-4,7-8,12H,5-6,9-11,17H2
InChIKeySLIJZRKPEXBBLR-UHFFFAOYSA-N
XLogP3.13
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(cyclopropylmethoxy)naphthalen-1-yl]ethanamine?
The IUPAC name of 2-[2-(cyclopropylmethoxy)naphthalen-1-yl]ethanamine (CID 54930636) is 2-[2-(cyclopropylmethoxy)naphthalen-1-yl]ethanamine.
What is the SMILES notation for 2-[2-(cyclopropylmethoxy)naphthalen-1-yl]ethanamine?
The canonical SMILES for 2-[2-(cyclopropylmethoxy)naphthalen-1-yl]ethanamine is NCCc1c(OCC2CC2)ccc2ccccc12.
What is the InChIKey of 2-[2-(cyclopropylmethoxy)naphthalen-1-yl]ethanamine?
The InChIKey is SLIJZRKPEXBBLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO/c17-10-9-15-14-4-2-1-3-13(14)7-8-16(15)18-11-12-5-6-12/h1-4,7-8,12H,5-6,9-11,17H2.
What are the key properties of 2-[2-(cyclopropylmethoxy)naphthalen-1-yl]ethanamine?
2-[2-(cyclopropylmethoxy)naphthalen-1-yl]ethanamine has a molecular weight of 241.33 g/mol, XLogP of 3.13, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(cyclopropylmethoxy)naphthalen-1-yl]ethanamine is sourced from PubChem (CID 54930636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).