1-methoxy-N-(naphthalen-1-ylmethyl)propan-2-amine

C15H19NO — CID 2852983

IUPAC1-methoxy-N-(naphthalen-1-ylmethyl)propan-2-amine
SMILESCOCC(C)NCc1cccc2ccccc12
InChIInChI=1S/C15H19NO/c1-12(11-17-2)16-10-14-8-5-7-13-6-3-4-9-15(13)14/h3-9,12,16H,10-11H2,1-2H3
InChIKeyPKIUGZHCULIPDQ-UHFFFAOYSA-N
MW229.32 g/mol
LogP2.96
Rot. Bonds5

About 1-methoxy-N-(naphthalen-1-ylmethyl)propan-2-amine

1-methoxy-N-(naphthalen-1-ylmethyl)propan-2-amine (PubChem CID 2852983) has the molecular formula C15H19NO and a molecular weight of 229.32 g/mol. Its IUPAC name is 1-methoxy-N-(naphthalen-1-ylmethyl)propan-2-amine.

Molecular Properties

Compound Name1-methoxy-N-(naphthalen-1-ylmethyl)propan-2-amine
PubChem CID2852983
Molecular FormulaC15H19NO
Molecular Weight229.32 g/mol
Exact Mass229.15
IUPAC Name1-methoxy-N-(naphthalen-1-ylmethyl)propan-2-amine
SMILESCOCC(C)NCc1cccc2ccccc12
InChIInChI=1S/C15H19NO/c1-12(11-17-2)16-10-14-8-5-7-13-6-3-4-9-15(13)14/h3-9,12,16H,10-11H2,1-2H3
InChIKeyPKIUGZHCULIPDQ-UHFFFAOYSA-N
XLogP2.96
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-methoxy-N-(naphthalen-1-ylmethyl)propan-2-amine?
The IUPAC name of 1-methoxy-N-(naphthalen-1-ylmethyl)propan-2-amine (CID 2852983) is 1-methoxy-N-(naphthalen-1-ylmethyl)propan-2-amine.
What is the SMILES notation for 1-methoxy-N-(naphthalen-1-ylmethyl)propan-2-amine?
The canonical SMILES for 1-methoxy-N-(naphthalen-1-ylmethyl)propan-2-amine is COCC(C)NCc1cccc2ccccc12.
What is the InChIKey of 1-methoxy-N-(naphthalen-1-ylmethyl)propan-2-amine?
The InChIKey is PKIUGZHCULIPDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO/c1-12(11-17-2)16-10-14-8-5-7-13-6-3-4-9-15(13)14/h3-9,12,16H,10-11H2,1-2H3.
What are the key properties of 1-methoxy-N-(naphthalen-1-ylmethyl)propan-2-amine?
1-methoxy-N-(naphthalen-1-ylmethyl)propan-2-amine has a molecular weight of 229.32 g/mol, XLogP of 2.96, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-N-(naphthalen-1-ylmethyl)propan-2-amine is sourced from PubChem (CID 2852983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).