1-naphthalen-2-yl-N-prop-2-enylmethanimine

C14H13N — CID 10899541

IUPAC1-naphthalen-2-yl-N-prop-2-enylmethanimine
SMILESC=CC/N=C/c1ccc2ccccc2c1
InChIInChI=1S/C14H13N/c1-2-9-15-11-12-7-8-13-5-3-4-6-14(13)10-12/h2-8,10-11H,1,9H2/b15-11+
InChIKeyDQMLNGCJZCIZRN-RVDMUPIBSA-N
MW195.26 g/mol
LogP3.44
Rot. Bonds3

About 1-naphthalen-2-yl-N-prop-2-enylmethanimine

1-naphthalen-2-yl-N-prop-2-enylmethanimine (PubChem CID 10899541) has the molecular formula C14H13N and a molecular weight of 195.26 g/mol. Its IUPAC name is 1-naphthalen-2-yl-N-prop-2-enylmethanimine.

Molecular Properties

Compound Name1-naphthalen-2-yl-N-prop-2-enylmethanimine
PubChem CID10899541
Molecular FormulaC14H13N
Molecular Weight195.26 g/mol
Exact Mass195.10
IUPAC Name1-naphthalen-2-yl-N-prop-2-enylmethanimine
SMILESC=CC/N=C/c1ccc2ccccc2c1
InChIInChI=1S/C14H13N/c1-2-9-15-11-12-7-8-13-5-3-4-6-14(13)10-12/h2-8,10-11H,1,9H2/b15-11+
InChIKeyDQMLNGCJZCIZRN-RVDMUPIBSA-N
XLogP3.44
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-2-yl-N-prop-2-enylmethanimine?
The IUPAC name of 1-naphthalen-2-yl-N-prop-2-enylmethanimine (CID 10899541) is 1-naphthalen-2-yl-N-prop-2-enylmethanimine.
What is the SMILES notation for 1-naphthalen-2-yl-N-prop-2-enylmethanimine?
The canonical SMILES for 1-naphthalen-2-yl-N-prop-2-enylmethanimine is C=CC/N=C/c1ccc2ccccc2c1.
What is the InChIKey of 1-naphthalen-2-yl-N-prop-2-enylmethanimine?
The InChIKey is DQMLNGCJZCIZRN-RVDMUPIBSA-N. The full InChI is InChI=1S/C14H13N/c1-2-9-15-11-12-7-8-13-5-3-4-6-14(13)10-12/h2-8,10-11H,1,9H2/b15-11+.
What are the key properties of 1-naphthalen-2-yl-N-prop-2-enylmethanimine?
1-naphthalen-2-yl-N-prop-2-enylmethanimine has a molecular weight of 195.26 g/mol, XLogP of 3.44, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-2-yl-N-prop-2-enylmethanimine is sourced from PubChem (CID 10899541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).