(E)-1-(2-methylnaphthalen-1-yl)prop-1-en-2-amine

C14H15N — CID 155088802

IUPAC(E)-1-(2-methylnaphthalen-1-yl)prop-1-en-2-amine
SMILESC/C(N)=C\c1c(C)ccc2ccccc12
InChIInChI=1S/C14H15N/c1-10-7-8-12-5-3-4-6-13(12)14(10)9-11(2)15/h3-9H,15H2,1-2H3/b11-9+
InChIKeySVJGQGVTUWEMJK-PKNBQFBNSA-N
MW197.28 g/mol
LogP3.47
Rot. Bonds1

About (E)-1-(2-methylnaphthalen-1-yl)prop-1-en-2-amine

(E)-1-(2-methylnaphthalen-1-yl)prop-1-en-2-amine (PubChem CID 155088802) has the molecular formula C14H15N and a molecular weight of 197.28 g/mol. Its IUPAC name is (E)-1-(2-methylnaphthalen-1-yl)prop-1-en-2-amine.

Molecular Properties

Compound Name(E)-1-(2-methylnaphthalen-1-yl)prop-1-en-2-amine
PubChem CID155088802
Molecular FormulaC14H15N
Molecular Weight197.28 g/mol
Exact Mass197.12
IUPAC Name(E)-1-(2-methylnaphthalen-1-yl)prop-1-en-2-amine
SMILESC/C(N)=C\c1c(C)ccc2ccccc12
InChIInChI=1S/C14H15N/c1-10-7-8-12-5-3-4-6-13(12)14(10)9-11(2)15/h3-9H,15H2,1-2H3/b11-9+
InChIKeySVJGQGVTUWEMJK-PKNBQFBNSA-N
XLogP3.47
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (E)-1-(2-methylnaphthalen-1-yl)prop-1-en-2-amine?
The IUPAC name of (E)-1-(2-methylnaphthalen-1-yl)prop-1-en-2-amine (CID 155088802) is (E)-1-(2-methylnaphthalen-1-yl)prop-1-en-2-amine.
What is the SMILES notation for (E)-1-(2-methylnaphthalen-1-yl)prop-1-en-2-amine?
The canonical SMILES for (E)-1-(2-methylnaphthalen-1-yl)prop-1-en-2-amine is C/C(N)=C\c1c(C)ccc2ccccc12.
What is the InChIKey of (E)-1-(2-methylnaphthalen-1-yl)prop-1-en-2-amine?
The InChIKey is SVJGQGVTUWEMJK-PKNBQFBNSA-N. The full InChI is InChI=1S/C14H15N/c1-10-7-8-12-5-3-4-6-13(12)14(10)9-11(2)15/h3-9H,15H2,1-2H3/b11-9+.
What are the key properties of (E)-1-(2-methylnaphthalen-1-yl)prop-1-en-2-amine?
(E)-1-(2-methylnaphthalen-1-yl)prop-1-en-2-amine has a molecular weight of 197.28 g/mol, XLogP of 3.47, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-(2-methylnaphthalen-1-yl)prop-1-en-2-amine is sourced from PubChem (CID 155088802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).